Chemical ID: 5073730

CCCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)C)c3ccccc3OC
Chemical ID:
5073730
Name [?]:
1-butyl-3-hydroxy-5-(2-methoxyphenyl)-4-(4-methylbenzoyl)-5H-pyrrol-2-one
SMILES [?]:
CCCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)C)c3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H25NO4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:10.0217
Area:583.063
Solvation:-4.55488
Coulombic:-51.8859
Bond Count [?]
All:30
Single:21
Double:9
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:379.449
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.9
LogP (Chemaxon):3.65

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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