Chemical ID: 4419851

c1ccc2c(c1)CCN(C2)S(=O)(=O)c3cccc(c3)C(=O)NC4CCCC4
Chemical ID:
4419851
Name [?]:
N-cyclopentyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide
SMILES [?]:
c1ccc2c(c1)CCN(C2)S(=O)(=O)c3cccc(c3)C(=O)NC4CCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H24N2O3S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:1
ZAP Information [?]
Total:11.722
Area:592.905
Solvation:-3.1006
Coulombic:-30.8629
Bond Count [?]
All:30
Single:21
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:384.493
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.33
LogP (Chemaxon):3.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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