Chemical ID: 7012211

CC(C)CCOc1ccc(cc1OC)C2C(=C(C(=O)N2Cc3ccccc3)O)C(=O)c4ccc(cc4)F
Chemical ID:
7012211
Name [?]:
1-benzyl-4-(4-fluorobenzoyl)-3-hydroxy-5-(4-isopentyloxy-3-methoxy-phenyl)-5H-pyrrol-2-one
SMILES [?]:
CC(C)CCOc1ccc(cc1OC)C2C(=C(C(=O)N2Cc3ccccc3)O)C(=O)c4ccc(cc4)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H30FNO5
All Atoms:67
Heavy Atoms:37
Chiral Atoms:1
ZAP Information [?]
Total:10.5037
Area:753.889
Solvation:-8.3435
Coulombic:-62.8248
Bond Count [?]
All:40
Single:28
Double:12
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:503.561
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:6.49
LogP (Chemaxon):5.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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