Chemical ID: 5291554

CCCCOc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)O)CCCOC)O
Chemical ID:
5291554
Name [?]:
4-(4-butoxybenzoyl)-3-hydroxy-5-(4-hydroxyphenyl)-1-(3-methoxypropyl)-5H-pyrrol-2-one
SMILES [?]:
CCCCOc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)O)CCCOC)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H29NO6
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:10.4146
Area:715.51
Solvation:-7.4731
Coulombic:-74.3849
Bond Count [?]
All:34
Single:25
Double:9
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:439.501
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:4.23
LogP (Chemaxon):2.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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