WHC is still in active development. Read this to understand our approach.
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Butabarbital

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Butabarbital

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Butabarbital

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Butabarbital

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Data

InChI: InChI=1S/C10H16N2O3/c1-4-6(3)10(5-2)7(13)11-9(15)12-8(10)14/h6H,4-5H2,1-3H3,(H2,11,12,13,14,15)

Synonyms: Secbutobarbital,SCHEMBL79254,Butatab,BUTABARBITAL [HSDB],NSC27517,Butrate,Butabarbital ciii, 5-sec-Butyl-5-ethylbarbituric acid,Secbutabarbitalum [INN-Latin],C07827, Secbutobarbitone,125-40-6, Butabarbitone, Buticaps,5-Ethyl-5-(1-methylpropyl)-2,4,6(1H,3H,5H)-pyrimidinetrione, Butisol (TN),P0078O25A9,NSC 27517,5-sec-Butyl-5-ethylmalonyl urea,Butabarbital (USP),BUTABARBITAL [USP MONOGRAPH],Butabarbital solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material,UNII-P0078O25A9, Sarisol, Medarsed,CHEBI:3228,Butisol,SECBUTABARBITAL [MART.], Secbubarbital, Butalan, Butabarbital [USAN],Butabarbital,Unicelles,Barbituric acid, 5-sec-butyl-5-ethyl-,2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(1-methylpropyl)-,BUTABARBITAL [VANDF], 5-sec-butyl-5-ethylpyrimidine-2,4,6(1H,3H,5H)-trione,Medarsed,DTXSID2022709,butabarbital,Secbutobarbitone,Nilox,SECBUTABARBITAL [WHO-DD], Butatab,Secbutabarbital [INN:BAN],5-(butan-2-yl)-5-ethylpyrimidine-2,4,6(1H,3H,5H)-trione, Secbutabarbitale, Secbutabarbitale [DCIT], Sodium butabarbital,Secbutabarbital (BAN),5-SEC-BUTYL-5-ETHYL-BARBITURIC ACID,WLN: T6VMVMV FHJ FY2 & 1 F2,Butabarb,DB00237,NSC-27517,HY-U00167,BUTABARBITAL [USP IMPURITY], Nilox, 5-Ethyl-5-(1-methylpropyl)barbiturate, 5-SEC-BUTYL-5-ETHYL-BARBITURIC ACID,5-(butan-2-yl)-5-ethyl-4,6-dihydroxy-2,5-dihydropyrimidin-2-one, 5-Ethyl-5-(1-methylpropyl)barbituric acid, Secbutabarbitalum [INN-Latin], 5-ethyl-5-(1-methylpropyl)pyrimidine-2,4,6(1H,3H,5H)-trione,Butabarbital [USP],BUTABARBITAL [MI],Butatal, 5-(butan-2-yl)-5-ethylpyrimidine-2,4,6(1H,3H,5H)-trione,BUTABARBITAL CIII [USP-RS],Secbutabarbitale [DCIT],HSDB 3018,5-Sec-butyl-5-ethyl-2,4,6(1H,3H,5H)-pyrimidinetrione #,5-Sec-butyl-5-ethyl-2,4,6(1H,3H,5H)-pyrimidinetrione,CS-7224,5-ethyl-5-(1-methylpropyl)pyrimidine-2,4,6(1H,3H,5H)-trione,Pyridium plus (Salt/Mix),Butabarbitone,AKOS015962208, 5-Sec-butyl-5-ethyl-2,4,6(1H,3H,5H)-pyrimidinetrione,Sodium butabarbital,Butabarbital (VAN),Secbutabarbital [INN], 5-sec-Butyl-5-ethylmalonyl urea,sec-Butobarbitone,Secbutabarbital,5-sec-Butyl-5-ethylbarbituric acid, Secbutabarbital,5-(Butan-2-yl)-5-ethylpyrimidine-2,4,6(1H,3H,5H)-trione,5-(butan-2-yl)-5-ethyl-1,3-diazinane-2,4,6-trione,SCHEMBL22556204, Butabarbital (VAN),GTPL7137,5-butan-2-yl-5-ethyl-1,3-diazinane-2,4,6-trione, Butisol sodium,Q410608,Buticaps, Secbutabarbitalum,Secbutabarbitalum, Secbutabarbital [INN],CHEMBL449, Secbutobarbital, 5-Ethyl-5-(1-methylpropyl)-2,4,6(1H,3H,5H)-pyrimidinetrione,5-Ethyl-5-(1-methylpropyl)barbiturate,D03180,Secbubarbital,Secbutabarbitale,BRN 0199127, Butisol, 5-Ethyl-5-isobutylbarbituric acid,EINECS 204-738-6, Unicelles, Butatal,5-Ethyl-5-(1-methylpropyl)barbituric acid, Sec-Butobarbitone, 5-butan-2-yl-5-ethyl-1,3-diazinane-2,4,6-trione,AC-16078,2,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(1-methylpropyl)-,5-sec-butyl-5-ethylpyrimidine-2,4,6(1H,3H,5H)-trione, Butrate

Estimated data

Solubility: -1.743 (log(S) in mol/L prediction using SolTranNet)

Blood Brain Barrier Permeability: No (prediction using frontiersin.org)

Addictivity Prediction: 37.5% (prediction based on www.mdpi.com)

Similarities

The following is a set of comparisons to understand the properties of this compound. This is still higly experimental and is still under active development. Please refer to our series of blog posts to fully understand our approach and its limitations. This information is for informational purposes only and should not be construed as medical advice.