N-(2-hydroxyethyl)-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-(2-hydroxyethyl)-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/bf6084765cac4c299fd6641e0dd4857e.png "N-(2-hydroxyethyl)-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-(2-hydroxyethyl)-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:
459421-07-9
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Formula:
C19H19N3O3S2
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Chemical Name:
N-(2-hydroxyethyl)-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:
459421-07-9;4-{[(4-hydroxy-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-N-(2-hydroxyethyl)benzamide;Oprea1_533320;Oprea1_554165;IFLab1_004735;HMS1425H05;ZINC8816922;MFCD02970082;SBB083619;STL079549;STL148286;AKOS002160880;AKOS005748022;MCULE-9988533437;IDI1_010490;AB00296441-02;SR-01000246965;SR-01000246965-1;Z56880253;F1102-0005;N-(2-hydroxyethyl)-4-(((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)methyl)benzamide;N-(2-hydroxyethyl)-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-(2-hydroxyethyl)-4-{[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzamide;N-(2-hydroxyethyl){4-[(4-oxo(3,5,6,7-tetrahydrocyclopenta[1,2-d]pyrimidino[4,5 -b]thiophen-2-ylthio))methyl]phenyl}carboxamide
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CAS No:
N-(2-hydroxyethyl)-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
401.5 g/mol
401.08678382 g/mol
Computed Properties
Molecular Weight:401.5
XLogP3:2.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:401.08678382
Monoisotopic Mass:401.08678382
Topological Polar Surface Area:144
Heavy Atom Count:27
Complexity:607
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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