DIFLUCORTOLONE

/static/temp/default.svg Search structure
Synonyms
Status
Molecule Category Free-form
ATC D07AC06 D07XC04
UNII K253365DXI
EPA CompTox DTXSID50180705

Structure

InChI Key OGPWIDANBSLJPC-RFPWEZLHSA-N
Smiles C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@H]1C(=O)CO
InChI
InChI=1S/C22H28F2O4/c1-11-6-13-14-8-16(23)15-7-12(26)4-5-21(15,3)22(14,24)18(28)9-20(13,2)19(11)17(27)10-25/h4-5,7,11,13-14,16,18-19,25,28H,6,8-10H2,1-3H3/t11-,13+,14+,16+,18+,19-,20+,21+,22+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H28F2O4
Molecular Weight 394.46
AlogP 2.73
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 74.6
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 28.0

Related Entries

Cross References

Resources Reference
ChEBI 135624
ChEMBL CHEMBL509924
DrugBank DB09095
DrugCentral 3141
FDA SRS K253365DXI
PubChem 11954369
SureChEMBL SCHEMBL3794
ZINC ZINC000004212939
CONTENTS