Chemical ID: 6008623

CCN(CC(=O)Nc1nc(cs1)C)C(=O)c2ccc(c(c2)[N+](=O)[O-])Cl
Chemical ID:
6008623
Name [?]:
4-chloro-N-ethyl-N-[(4-methylthiazol-2-yl)carbamoylmethyl]-3-nitro-benzamide
SMILES [?]:
CCN(CC(=O)Nc1nc(cs1)C)C(=O)c2ccc(c(c2)[N+](=O)[O-])Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H15ClN4O4S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:4.44657
Area:569.798
Solvation:-9.79839
Coulombic:-51.5201
Bond Count [?]
All:26
Single:18
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:382.823
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.24
LogP (Chemaxon):2.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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