Chemical ID: 4407474

Cc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)N4CCCCC4
Chemical ID:
4407474
Name [?]:
1-piperidyl-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl]-methanone
SMILES [?]:
Cc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)N4CCCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H26N2O3S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:2
ZAP Information [?]
Total:10.0305
Area:552.018
Solvation:-3.76997
Coulombic:-25.4377
Bond Count [?]
All:31
Single:22
Double:9
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:398.52
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:3.38
LogP (Chemaxon):3.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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