Chemical ID: 5510239

c1ccc(cc1)CCNC(=O)C2Cc3ccccc3CN2S(=O)(=O)c4ccc(cc4)Cl
Chemical ID:
5510239
Name [?]:
2-(4-chlorophenyl)sulfonyl-N-phenethyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
SMILES [?]:
c1ccc(cc1)CCNC(=O)C2Cc3ccccc3CN2S(=O)(=O)c4ccc(cc4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H23ClN2O3S
All Atoms:31
Heavy Atoms:31
Chiral Atoms:2
ZAP Information [?]
Total:13.0613
Area:653.121
Solvation:-3.26675
Coulombic:-32.6817
Bond Count [?]
All:34
Single:22
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:454.97
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.43
LogP (Chemaxon):4.6

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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