Chemical ID: 4157381

c1ccc(cc1)NC(=O)Cn2cnc3c(c2=O)c(cs3)c4cccc(c4)[N+](=O)[O-]
Chemical ID:
4157381
Name [?]:
2-[7-(3-nitrophenyl)-5-oxo-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-4-yl]-N-phenyl-acetamide
SMILES [?]:
c1ccc(cc1)NC(=O)Cn2cnc3c(c2=O)c(cs3)c4cccc(c4)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H14N4O4S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:6.19674
Area:600.443
Solvation:-8.81435
Coulombic:-54.8259
Bond Count [?]
All:32
Single:20
Double:12
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:406.416
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.55
LogP (Chemaxon):3.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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