Primary record
Dapagliflozin propanediol
- CAS
- 960404-48-2
- PubChem CID
- 24906252
- SMILES
- CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)Cl.C[C@@H](CO)O.O
- Molecular Formula
- C24H35ClO9
- Molecular Weight
- 502.988
- Exact Mass
- 502.197
- InChI
- InChI=1S/C21H25ClO6.C3H8O2.H2O/c1-2-27-15-6-3-12(4-7-15)9-14-10-13(5-8-16(14)22)21-20(26)19(25)18(24)17(11-23)28-21;1-3(5)2-4;/h3-8,10,17-21,23-26H,2,9,11H2,1H3;3-5H,2H2,1H3;1H2/t17-,18-,19+,20-,21+;3-;/m10./s1
- InChIKey
- GOADIQFWSVMMRJ-UPGAGZFNSA-N
- LogP
- 0.3792
- TPSA
- 171.34
Names and synonyms
- Dapagliflozin propanediol
- Dapagliflozin propanediol hydrate
- Farxiga
- Forxiga
- dapagliflozin propanediol monohydrate
- 960404-48-2
- Dapagliflozin
- RefChem:5730
- Dapagliflozin propylene glycolate hydrate
- UNII-887K2391VH
- Dapagliflozin [USAN:INN]
- Dapagliflozin propylene glycol hydrate
- C24H35ClO9
- CHEBI:85079
- Dapagliflozin propanediol [USAN]
- MFCD28167768
- orb1302841
- Dapagliflozin S-propylene glycol monohydrate
- 887K2391VH
- CHEMBL2103802
- SCHEMBL29361318
- SCHEMBL29378018
- KS-00000SPY
- BMS-512148-05
- DTXSID00914678
- HY-10450AR
- Dapagliflozin ((2S)-1,2-propanediol, hydrate)
- Dapagliflozin propandiol monohydrate
- dapagliflozin (S)-propylene glycol hydrate
- EX-A2824