Chemical ID: 6620765

Cc1c(c(no1)c2ccccc2Cl)C(=O)NC(=S)NC3CC(CC(C3)(C)C)C
Chemical ID:
6620765
Name [?]:
3-(2-chlorophenyl)-5-methyl-N-[(3,3,5-trimethylcyclohexyl)thiocarbamoyl]isoxazole-4-carboxamide
SMILES [?]:
Cc1c(c(no1)c2ccccc2Cl)C(=O)NC(=S)NC3CC(CC(C3)(C)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H26ClN3O2S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:2
ZAP Information [?]
Total:12.7243
Area:627.125
Solvation:-2.95384
Coulombic:-39.109
Bond Count [?]
All:30
Single:23
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:419.969
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:6.68
LogP (Chemaxon):5.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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