N-[2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetyl]-3-nitrobenzamide
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N-[2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetyl]-3-nitrobenzamide
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CAS No:
752221-21-9
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Formula:
C19H16N4O4S2
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Chemical Name:
N-[2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetyl]-3-nitrobenzamide
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Synonyms:
ZINC2725914;AKOS033737491;MCULE-3150297350;Z20233310;752221-21-9;N-[2-({10-methyl-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9,11-tetraen-12-yl}sulfanyl)acetyl]-3-nitrobenzamide
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CAS No:
N-[2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetyl]-3-nitrobenzamide Basic Attributes
428.5 g/mol
428.06129735 g/mol
Computed Properties
Molecular Weight:428.5
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:428.06129735
Monoisotopic Mass:428.06129735
Topological Polar Surface Area:171
Heavy Atom Count:29
Complexity:661
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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