Chemical ID: 5915853

Cc1ccc(cc1[N+](=O)[O-])C(=O)N(CC=C)CC(=O)N(Cc2ccccc2)Cc3cccs3
Chemical ID:
5915853
Name [?]:
N-allyl-N-[(benzyl-(2-thienylmethyl)carbamoyl)methyl]-4-methyl-3-nitro-benzamide
SMILES [?]:
Cc1ccc(cc1[N+](=O)[O-])C(=O)N(CC=C)CC(=O)N(Cc2ccccc2)Cc3cccs3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H25N3O4S
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:7.61668
Area:647.846
Solvation:-8.57947
Coulombic:-49.7208
Bond Count [?]
All:35
Single:23
Double:12
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:463.55
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:3.97
LogP (Chemaxon):4.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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