Chemical ID: 3912771

COc1ccc(cc1OC)CCN(C(c2ccccc2)C(=O)NC3CCCC3)C(=O)c4cccs4
Chemical ID:
3912771
Name [?]:
N-(cyclopentylcarbamoyl-phenyl-methyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]thiophene-2-carboxamide
SMILES [?]:
COc1ccc(cc1OC)CCN(C(c2ccccc2)C(=O)NC3CCCC3)C(=O)c4cccs4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H32N2O4S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:10.521
Area:697.113
Solvation:-6.90686
Coulombic:-56.2631
Bond Count [?]
All:38
Single:28
Double:10
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:492.631
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.03
LogP (Chemaxon):4.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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