Chemical ID: 4832452

CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)c2cccc(c2)OC)c3ccc(cc3)C(C)C
Chemical ID:
4832452
Name [?]:
1-(3-diethylaminopropyl)-3-hydroxy-5-(4-isopropylphenyl)-4-(3-methoxybenzoyl)-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)c2cccc(c2)OC)c3ccc(cc3)C(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H36N2O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:12.5681
Area:728.687
Solvation:-5.64913
Coulombic:-56.4094
Bond Count [?]
All:36
Single:27
Double:9
Rotors:11
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:464.597
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:5.58
LogP (Chemaxon):0.97

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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