Chemical ID: 4901317

CC(C)COc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3ccccc3OC)CCN(C)C)O
Chemical ID:
4901317
Name [?]:
1-(2-dimethylaminoethyl)-3-hydroxy-4-(4-isobutoxybenzoyl)-5-(2-methoxyphenyl)-5H-pyrrol-2-one
SMILES [?]:
CC(C)COc1ccc(cc1)C(=O)C2=C(C(=O)N(C2c3ccccc3OC)CCN(C)C)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H32N2O5
All Atoms:33
Heavy Atoms:33
Chiral Atoms:1
ZAP Information [?]
Total:11.7844
Area:698.755
Solvation:-5.68448
Coulombic:-64.4279
Bond Count [?]
All:35
Single:26
Double:9
Rotors:10
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:452.543
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.96
LogP (Chemaxon):0.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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