Chemical ID: 4419460

CCCOc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3cccc(c3)Br)CCN(C)C)O
Chemical ID:
4419460
Name [?]:
5-(3-bromophenyl)-1-(2-dimethylaminoethyl)-3-hydroxy-4-(4-propoxybenzoyl)-5H-pyrrol-2-one
SMILES [?]:
CCCOc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3cccc(c3)Br)CCN(C)C)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H27BrN2O4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:12.2154
Area:694.838
Solvation:-5.15559
Coulombic:-56.5681
Bond Count [?]
All:33
Single:24
Double:9
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:487.386
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.55
LogP (Chemaxon):0.99

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Descriptor Annotations

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