Chemical ID: 7032879

CCOc1ccc(cc1OCC)C2C(=C(C(=O)N2CCCOC)O)C(=O)c3ccc(cc3)C
Chemical ID:
7032879
Name [?]:
5-(3,4-diethoxyphenyl)-3-hydroxy-1-(3-methoxypropyl)-4-(4-methylbenzoyl)-5H-pyrrol-2-one
SMILES [?]:
CCOc1ccc(cc1OCC)C2C(=C(C(=O)N2CCCOC)O)C(=O)c3ccc(cc3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H31NO6
All Atoms:64
Heavy Atoms:33
Chiral Atoms:1
ZAP Information [?]
Total:9.60157
Area:728.297
Solvation:-8.60585
Coulombic:-64.8746
Bond Count [?]
All:35
Single:26
Double:9
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:453.527
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:4.21
LogP (Chemaxon):2.76

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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