Chemical ID: 3993435

CC(C(=O)Nc1nc(cs1)c2cccc(c2)[N+](=O)[O-])Cl
Chemical ID:
3993435
Name [?]:
2-chloro-N-[4-(3-nitrophenyl)thiazol-2-yl]-propanamide
SMILES [?]:
CC(C(=O)Nc1nc(cs1)c2cccc(c2)[N+](=O)[O-])Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H10ClN3O3S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:4.3956
Area:501.441
Solvation:-8.14042
Coulombic:-38.1677
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:311.745
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.41
LogP (Chemaxon):3.8

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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