Chemical ID: 3890951

COc1ccc(cc1OC)CCN(c2nc(cs2)c3ccccc3)C(=O)CCCl
Chemical ID:
3890951
Name [?]:
3-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-phenylthiazol-2-yl)-propanamide
SMILES [?]:
COc1ccc(cc1OC)CCN(c2nc(cs2)c3ccccc3)C(=O)CCCl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H23ClN2O3S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:9.83418
Area:661.515
Solvation:-6.7037
Coulombic:-36.8081
Bond Count [?]
All:31
Single:22
Double:9
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:430.948
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.28
LogP (Chemaxon):4.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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