Chemical ID: 4795585

CCCOc1ccc(cc1OC)C2C(=C(C(=O)N2CCN(C)C)O)C(=O)c3ccc(cc3)Br
Chemical ID:
4795585
Name [?]:
4-(4-bromobenzoyl)-1-(2-dimethylaminoethyl)-3-hydroxy-5-(3-methoxy-4-propoxy-phenyl)-5H-pyrrol-2-one
SMILES [?]:
CCCOc1ccc(cc1OC)C2C(=C(C(=O)N2CCN(C)C)O)C(=O)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H29BrN2O5
All Atoms:33
Heavy Atoms:33
Chiral Atoms:1
ZAP Information [?]
Total:10.5573
Area:728.886
Solvation:-7.66488
Coulombic:-62.2639
Bond Count [?]
All:35
Single:26
Double:9
Rotors:10
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:517.412
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:4.19
LogP (Chemaxon):0.72

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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