Chemical ID: 4566570

CCOc1ccc(cc1OCC)CC2c3cc(c(cc3CCN2C(=O)C4CC4)OCC)OCC
Chemical ID:
4566570
Name [?]:
cyclopropyl-[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-methanone
SMILES [?]:
CCOc1ccc(cc1OCC)CC2c3cc(c(cc3CCN2C(=O)C4CC4)OCC)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H37NO5
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:8.38614
Area:648.987
Solvation:-7.83854
Coulombic:-45.6515
Bond Count [?]
All:37
Single:30
Double:7
Rotors:12
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:467.597
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.4
LogP (Chemaxon):4.36

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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