[2-(4-chloro-3-nitroanilino)-2-oxoethyl] 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate
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![[2-(4-chloro-3-nitroanilino)-2-oxoethyl] 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9603699cd70a458fa067e761d3f82a15.png "[2-(4-chloro-3-nitroanilino)-2-oxoethyl] 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate")
[2-(4-chloro-3-nitroanilino)-2-oxoethyl] 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate
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CAS No:
752220-49-8
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Formula:
C22H19ClN4O6
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Chemical Name:
[2-(4-chloro-3-nitroanilino)-2-oxoethyl] 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate
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Synonyms:
ZINC2725810;AKOS033410576;MCULE-6833199437;Z15388503;[(4-chloro-3-nitrophenyl)carbamoyl]methyl 12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazoline-3-carboxylate;752220-49-8
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CAS No:
[2-(4-chloro-3-nitroanilino)-2-oxoethyl] 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate Basic Attributes
470.9 g/mol
470.0993120 g/mol
Computed Properties
Molecular Weight:470.9
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:470.0993120
Monoisotopic Mass:470.0993120
Topological Polar Surface Area:134
Heavy Atom Count:33
Complexity:830
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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