Chemical ID: 4563913

COc1cc2c(cc1OC)CN(CC2)c3c4cc(c(cc4nc(n3)c5ccccc5)OC)OC
Chemical ID:
4563913
Name [?]:
4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-6,7-dimethoxy-2-phenyl-quinazoline
SMILES [?]:
COc1cc2c(cc1OC)CN(CC2)c3c4cc(c(cc4nc(n3)c5ccccc5)OC)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H27N3O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:8.85525
Area:683.108
Solvation:-8.22245
Coulombic:-47.6673
Bond Count [?]
All:38
Single:27
Double:11
Rotors:6
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:457.521
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.73
LogP (Chemaxon):5.07

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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