Chemical Component Summary

Name6-METHYL-2(PROPANE-1-SULFONYL)-2H-THIENO[3,2-D][1,2,3]DIAZABORININ-1-OL
SynonymsDiazaborine
Identifiers1-hydroxy-6-methyl-2-propylsulfonyl-thieno[3,2-d][1,2,3]diazaborinine
FormulaC9 H13 B N2 O3 S2
Molecular Weight272.152
TypeNON-POLYMER
Isomeric SMILESB1(c2cc(sc2C=NN1S(=O)(=O)CCC)C)O
InChIInChI=1S/C9H13BN2O3S2/c1-3-4-17(14,15)12-10(13)8-5-7(2)16-9(8)6-11-12/h5-6,13H,3-4H2,1-2H3
InChIKeyTVXLILKNSPCVRB-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count30
Chiral Atom Count0
Bond Count31
Aromatic Bond Count5

Drug Info: DrugBank

DrugBank IDDB08605 
Name6-METHYL-2(PROPANE-1-SULFONYL)-2H-THIENO[3,2-D][1,2,3]DIAZABORININ-1-OL
Groups experimental
Synonyms6-METHYL-2(PROPANE-1-SULFONYL)-2H-THIENO[3,2-D][1,2,3]DIAZABORININ-1-OL

Drug Targets

NameTarget SequencePharmacological ActionActions
2,4-dienoyl-CoA reductase, mitochondrialMKLPARVFFTLGSRLPCGLAPRRFFSYGTKILYQNTEALQSKFFSPLQKA...unknown
Enoyl-[acyl-carrier-protein] reductase [NADH] FabIMGFLSGKRILVTGVASKLSIAYGIAQAMHREGAELAFTYQNDKLKGRVEE...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 171833
ChEMBL CHEMBL174539