Chemical ID: 5977631

Cc1ccc(cc1)n2c(nnc2SCc3cccc(c3)C)C(C)NC(=O)C(c4ccccc4)Cl
Chemical ID:
5977631
Name [?]:
2-chloro-N-[1-[5-(m-tolylmethylsulfanyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]ethyl]-2-phenyl-acetamide
SMILES [?]:
Cc1ccc(cc1)n2c(nnc2SCc3cccc(c3)C)C(C)NC(=O)C(c4ccccc4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H27ClN4OS
All Atoms:34
Heavy Atoms:34
Chiral Atoms:2
ZAP Information [?]
Total:16.0615
Area:760.809
Solvation:-2.95872
Coulombic:-38.5115
Bond Count [?]
All:37
Single:25
Double:12
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:491.048
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:7.65
LogP (Chemaxon):6.56

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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