Chemical ID: 4577342

Cc1cc(cc(c1)NC(=O)CN2CCC3(CCCCC3C2c4ccc(cc4OC)OC)O)C
Chemical ID:
4577342
Name [?]:
2-[1-(2,4-dimethoxyphenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-N-(3,5-dimethylphenyl)-acetamide
SMILES [?]:
Cc1cc(cc(c1)NC(=O)CN2CCC3(CCCCC3C2c4ccc(cc4OC)OC)O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H36N2O4
All Atoms:33
Heavy Atoms:33
Chiral Atoms:4
ZAP Information [?]
Total:10.0427
Area:672.285
Solvation:-6.76445
Coulombic:-56.5582
Bond Count [?]
All:36
Single:29
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:452.586
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.45
LogP (Chemaxon):4.01

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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