Chemical ID: 4299353

CC1CCc2c(sc(c2C(=O)Nc3ccc(cc3)Cl)NC(=O)c4ccccc4)C1
Chemical ID:
4299353
Name [?]:
2-benzamido-N-(4-chlorophenyl)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide
SMILES [?]:
CC1CCc2c(sc(c2C(=O)Nc3ccc(cc3)Cl)NC(=O)c4ccccc4)C1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H21ClN2O2S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:13.1776
Area:642.104
Solvation:-2.87499
Coulombic:-45.3953
Bond Count [?]
All:32
Single:22
Double:10
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:424.944
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:5.24
LogP (Chemaxon):5.43

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue