Chemical ID: 5126535

Cc1c(sc(c1C#N)NC(=O)CSc2nnc(n2c3ccccc3)c4ccc(cc4)Cl)C
Chemical ID:
5126535
Name [?]:
2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-cyano-4,5-dimethyl-2-thienyl)-acetamide
SMILES [?]:
Cc1c(sc(c1C#N)NC(=O)CSc2nnc(n2c3ccccc3)c4ccc(cc4)Cl)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H18ClN5OS2
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:14.4325
Area:710.763
Solvation:-3.33662
Coulombic:-37.9562
Bond Count [?]
All:35
Single:23
Double:11
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:480.007
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:6.21
LogP (Chemaxon):5.1

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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