Chemical ID: 7012015

CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)C)c3ccc(c(c3)OCC)O
Chemical ID:
7012015
Name [?]:
1-(3-diethylaminopropyl)-5-(3-ethoxy-4-hydroxy-phenyl)-3-hydroxy-4-(4-methylbenzoyl)-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)C)c3ccc(c(c3)OCC)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H34N2O5
All Atoms:68
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:12.0196
Area:748.163
Solvation:-6.6845
Coulombic:-71.5236
Bond Count [?]
All:36
Single:27
Double:9
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:466.569
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:4.62
LogP (Chemaxon):0.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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