Chemical ID: 4468569

COc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)NC4CCCCC4
Chemical ID:
4468569
Name [?]:
N-cyclohexyl-2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
SMILES [?]:
COc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)NC4CCCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H28N2O4S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:2
ZAP Information [?]
Total:11.146
Area:604.682
Solvation:-3.97103
Coulombic:-38.0464
Bond Count [?]
All:33
Single:24
Double:9
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:428.546
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.68
LogP (Chemaxon):3.38

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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