Chemical ID: 4863419

CCCOc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)OC(C)C)CCCN(CC)CC)O
Chemical ID:
4863419
Name [?]:
1-(3-diethylaminopropyl)-3-hydroxy-5-(4-isopropoxyphenyl)-4-(4-propoxybenzoyl)-5H-pyrrol-2-one
SMILES [?]:
CCCOc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)OC(C)C)CCCN(CC)CC)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H40N2O5
All Atoms:37
Heavy Atoms:37
Chiral Atoms:1
ZAP Information [?]
Total:14.3086
Area:827.673
Solvation:-6.38321
Coulombic:-63.7806
Bond Count [?]
All:39
Single:30
Double:9
Rotors:14
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:508.649
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:5.75
LogP (Chemaxon):1.06

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