Chemical ID: 4654793

COc1cccc(c1)C2C(=C(C(=O)N2CCN3CCOCC3)O)C(=O)c4ccc(cc4)Br
Chemical ID:
4654793
Name [?]:
4-(4-bromobenzoyl)-3-hydroxy-5-(3-methoxyphenyl)-1-(2-morpholinoethyl)-5H-pyrrol-2-one
SMILES [?]:
COc1cccc(c1)C2C(=C(C(=O)N2CCN3CCOCC3)O)C(=O)c4ccc(cc4)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H25BrN2O5
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:10.4217
Area:684.909
Solvation:-6.70098
Coulombic:-63.6399
Bond Count [?]
All:35
Single:26
Double:9
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:501.37
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.36
LogP (Chemaxon):0.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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