Chemical ID: 6003203

Cc1csc(n1)NC(=O)CN(CCC(C)C)C(=O)c2ccc(cc2Cl)[N+](=O)[O-]
Chemical ID:
6003203
Name [?]:
2-chloro-N-isopentyl-N-[(4-methylthiazol-2-yl)carbamoylmethyl]-4-nitro-benzamide
SMILES [?]:
Cc1csc(n1)NC(=O)CN(CCC(C)C)C(=O)c2ccc(cc2Cl)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H21ClN4O4S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:5.909
Area:641.683
Solvation:-10.1331
Coulombic:-51.8839
Bond Count [?]
All:29
Single:21
Double:8
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:424.903
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.68
LogP (Chemaxon):3.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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