Chemical ID: 5878010

CCCCCN(CC(=O)N1CCc2ccccc2C1C)C(=O)Nc3ccc(cc3)Cl
Chemical ID:
5878010
Name [?]:
3-(4-chlorophenyl)-1-[(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonylmethyl]-1-pentyl-urea
SMILES [?]:
CCCCCN(CC(=O)N1CCc2ccccc2C1C)C(=O)Nc3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H30ClN3O2
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:13.6142
Area:678.925
Solvation:-3.35892
Coulombic:-49.1085
Bond Count [?]
All:32
Single:24
Double:8
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:427.967
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.99
LogP (Chemaxon):5.06

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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