Chemical ID: 4616324

Cc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)NCc4cccc(c4)Oc5ccccc5
Chemical ID:
4616324
Name [?]:
N-[(3-phenoxyphenyl)methyl]-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
SMILES [?]:
Cc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)NCc4cccc(c4)Oc5ccccc5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H28N2O4S
All Atoms:37
Heavy Atoms:37
Chiral Atoms:2
ZAP Information [?]
Total:13.908
Area:732.49
Solvation:-4.40429
Coulombic:-40.1754
Bond Count [?]
All:41
Single:26
Double:15
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:512.62
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:5.57
LogP (Chemaxon):5.72

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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