Chemical ID: 5914726

COc1ccc(cc1OC)CCN(Cc2cccs2)C(=O)CN(C3CC3)C(=O)Cc4ccccc4
Chemical ID:
5914726
Name [?]:
2-[cyclopropyl-(2-phenylacetyl)-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-thienylmethyl)acetamide
SMILES [?]:
COc1ccc(cc1OC)CCN(Cc2cccs2)C(=O)CN(C3CC3)C(=O)Cc4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H32N2O4S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:11.1751
Area:761.902
Solvation:-7.87243
Coulombic:-48.0023
Bond Count [?]
All:38
Single:28
Double:10
Rotors:14
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:492.631
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.44
LogP (Chemaxon):3.59

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