Chemical ID: 5128479

Cc1ccc(cc1NC(=O)CSc2nc3c(c(c(s3)C)C)c(=O)n2c4ccccc4)[N+](=O)[O-]
Chemical ID:
5128479
Name [?]:
2-[(7,8-dimethyl-5-oxo-4-phenyl-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-3-yl)sulfanyl]-N-(2-methyl-5-nitro-phenyl)-acetamide
SMILES [?]:
Cc1ccc(cc1NC(=O)CSc2nc3c(c(c(s3)C)C)c(=O)n2c4ccccc4)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H20N4O4S2
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:8.52179
Area:697.36
Solvation:-8.9122
Coulombic:-55.1566
Bond Count [?]
All:36
Single:24
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:480.561
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.97
LogP (Chemaxon):4.93

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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