Chemical ID: 5891271

Cc1ccccc1CSc2nnc(n2c3cc(ccc3C)Cl)C(C)NC(=O)C4CCC4
Chemical ID:
5891271
Name [?]:
N-[1-[4-(5-chloro-2-methyl-phenyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]cyclobutanecarboxamide
SMILES [?]:
Cc1ccccc1CSc2nnc(n2c3cc(ccc3C)Cl)C(C)NC(=O)C4CCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H27ClN4OS
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:15.176
Area:702.228
Solvation:-2.37971
Coulombic:-36.1572
Bond Count [?]
All:34
Single:25
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:455.016
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:7.11
LogP (Chemaxon):5.6

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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