Chemical ID: 5127470

Cn1c(cnc1SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])c3ccccc3
Chemical ID:
5127470
Name [?]:
2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-N-(4-nitrophenyl)-acetamide
SMILES [?]:
Cn1c(cnc1SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])c3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H16N4O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:6.16691
Area:586.481
Solvation:-8.4951
Coulombic:-44.7702
Bond Count [?]
All:28
Single:18
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:368.411
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.21
LogP (Chemaxon):3.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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