Chemical ID: 5281749

CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)OCC(C)C)c3ccc(cc3)Cl
Chemical ID:
5281749
Name [?]:
5-(4-chlorophenyl)-1-(2-diethylaminoethyl)-3-hydroxy-4-(4-isobutoxybenzoyl)-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)c2ccc(cc2)OCC(C)C)c3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H33ClN2O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:13.2167
Area:732.982
Solvation:-5.10783
Coulombic:-57.6078
Bond Count [?]
All:36
Single:27
Double:9
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:485.015
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:5.51
LogP (Chemaxon):1.76

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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