Chemical ID: 5706322

C=CCn1c(nnc1SCC(=O)NC2CCCC2)c3ccccc3
Chemical ID:
5706322
Name [?]:
2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopentyl-acetamide
SMILES [?]:
C=CCn1c(nnc1SCC(=O)NC2CCCC2)c3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H22N4OS
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.5773
Area:563.11
Solvation:-2.50043
Coulombic:-36.4726
Bond Count [?]
All:26
Single:19
Double:7
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:342.46
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.84
LogP (Chemaxon):3.07

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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