Chemical ID: 7012000

CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)Cl)c3cccc(c3)O
Chemical ID:
7012000
Name [?]:
4-(4-chlorobenzoyl)-1-(3-diethylaminopropyl)-3-hydroxy-5-(3-hydroxyphenyl)-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)Cl)c3cccc(c3)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H27ClN2O4
All Atoms:58
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:12.3305
Area:701.35
Solvation:-5.20327
Coulombic:-64.8577
Bond Count [?]
All:33
Single:24
Double:9
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:442.935
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.47
LogP (Chemaxon):0.23

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Experimental Annotations

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Descriptor Annotations

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