Chemical ID: 7620494

CCOC(=O)Cc1cc(c(n1C)C(=O)c2ccc(cc2)Cl)C
Chemical ID:
7620494
Name [?]:
ethyl 2-[5-(4-chlorobenzoyl)-1,4-dimethyl-pyrrol-2-yl]acetate
SMILES [?]:
CCOC(=O)Cc1cc(c(n1C)C(=O)c2ccc(cc2)Cl)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H18ClNO3
All Atoms:40
Heavy Atoms:22
Chiral Atoms:None
ZAP Information [?]
Total:10.1907
Area:540.466
Solvation:-3.321
Coulombic:-34.2305
Bond Count [?]
All:23
Single:16
Double:7
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.64
LogP (Chemaxon):None

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