Chemical ID: 4404779

CC(C)Oc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)Cl)CCN4CCNCC4)O
Chemical ID:
4404779
Name [?]:
5-(4-chlorophenyl)-3-hydroxy-4-(4-isopropoxybenzoyl)-1-(2-piperazin-1-ylethyl)-5H-pyrrol-2-one
SMILES [?]:
CC(C)Oc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3ccc(cc3)Cl)CCN4CCNCC4)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H30ClN3O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:12.9525
Area:736.196
Solvation:-5.45245
Coulombic:-64.9563
Bond Count [?]
All:37
Single:28
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:483.987
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:3.88
LogP (Chemaxon):-0.87

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Descriptor Annotations

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