Chemical ID: 4332914

CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)C=Cc2ccccc2)c3ccc(cc3)Br
Chemical ID:
4332914
Name [?]:
5-(4-bromophenyl)-1-(2-diethylaminoethyl)-3-hydroxy-4-(3-phenylprop-2-enoyl)-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCN1C(C(=C(C1=O)O)C(=O)C=Cc2ccccc2)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H27BrN2O3
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:11.3891
Area:654.911
Solvation:-4.98372
Coulombic:-48.9632
Bond Count [?]
All:33
Single:23
Double:10
Rotors:9
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:483.398
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.97
LogP (Chemaxon):1.61

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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