Chemical ID: 3990836

CC(C)(C)C1Cc2c(c3ccccc3nc2C(=Cc4cc(c(c(c4)OC)OC)OC)C1)C(=O)O
Chemical ID:
3990836
Name [?]:
2-tert-butyl-4-[(3,4,5-trimethoxyphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid
SMILES [?]:
CC(C)(C)C1Cc2c(c3ccccc3nc2C(=Cc4cc(c(c(c4)OC)OC)OC)C1)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H31NO5
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:9.81768
Area:646.08
Solvation:-6.33432
Coulombic:-56.9467
Bond Count [?]
All:37
Single:27
Double:10
Rotors:6
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:461.549
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.96
LogP (Chemaxon):5.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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