N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide
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![N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/aeb2cf7a0d20422ebc5fa7a25ff3cefb.png "N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide")
N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide
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CAS No:
433700-37-9
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Formula:
C20H21N3O3S2
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Chemical Name:
N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide
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Synonyms:
CHEMBL205921;433700-37-9;N-(3-hydroxypropyl){4-[(4-oxo(3,5,6,7-tetrahydrocyclopenta[1,2-d]pyrimidino[4, 5-b]thiophen-2-ylthio))methyl]phenyl}carboxamide;Cambridge id 6944657;ZINC9046288;BDBM50183478;MFCD02970078;SBB083610;STL079543;STL148942;AKOS001058631;AKOS005750365;MCULE-7984427737;ST50032570;AB00296378-02;SR-01000246910;SR-01000246910-1;F1102-0006;4-{[(4-hydroxy-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-N-(3-hydroxypropyl)benzamide;Benzamide, N-(3-hydroxypropyl)-4-[[(3,5,6,7-tetrahydro-4-oxo-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio]methyl]-;N-(3-Hydroxy-propyl)-4-(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-ylsulfanylmthyl)-benzamide;N-(3-hydroxypropyl)-4-(((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)methyl)benzamide;N-(3-hydroxypropyl)-4-[(1-oxo-2,6,7,8-tetrahydrocyclopenta[[?]:[?]]thieno[[?]]pyrimidin-3-yl)sulfanylmethyl]benzamide;N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide;N-(3-hydroxypropyl)-4-{[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzamide
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CAS No:
N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide Basic Attributes
415.5 g/mol
415.10243389 g/mol
Computed Properties
Molecular Weight:415.5
XLogP3:2.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:415.10243389
Monoisotopic Mass:415.10243389
Topological Polar Surface Area:144
Heavy Atom Count:28
Complexity:622
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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