Chemical ID: 5877952

CCCC(=O)N(CCc1ccccc1)C(CC)c2nc3ccccc3c(=O)n2c4ccc(cc4)CC
Chemical ID:
5877952
Name [?]:
N-[1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-phenethyl-butanamide
SMILES [?]:
CCCC(=O)N(CCc1ccccc1)C(CC)c2nc3ccccc3c(=O)n2c4ccc(cc4)CC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C31H35N3O2
All Atoms:36
Heavy Atoms:36
Chiral Atoms:1
ZAP Information [?]
Total:14.8628
Area:718.209
Solvation:-3.09239
Coulombic:-43.0023
Bond Count [?]
All:39
Single:27
Double:12
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:481.629
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:6.43
LogP (Chemaxon):6.67

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue