Chemical ID: 4246688

Cc1c(sc(n1)N)c2nnc(n2CC=C)SCC(=O)NC3CCCCC3
Chemical ID:
4246688
Name [?]:
2-[[4-allyl-5-(2-amino-4-methyl-thiazol-5-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-acetamide
SMILES [?]:
Cc1c(sc(n1)N)c2nnc(n2CC=C)SCC(=O)NC3CCCCC3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H24N6OS2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:12.4091
Area:605.778
Solvation:-2.73531
Coulombic:-56.7566
Bond Count [?]
All:28
Single:22
Double:6
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:392.544
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:3.3
LogP (Chemaxon):1.86

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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