Primary record
regorafenib monohydrate
- CAS
- 1019206-88-2
- PubChem CID
- 24768591
- SMILES
- CNC(=O)C1=NC=CC(=C1)OC2=CC(=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)F.O
- Molecular Formula
- C21H17ClF4N4O4
- Molecular Weight
- 500.836
- Exact Mass
- 500.0874
- InChI
- InChI=1S/C21H15ClF4N4O3.H2O/c1-27-19(31)18-10-13(6-7-28-18)33-12-3-5-17(16(23)9-12)30-20(32)29-11-2-4-15(22)14(8-11)21(24,25)26;/h2-10H,1H3,(H,27,31)(H2,29,30,32);1H2
- InChIKey
- ZOPOQLDXFHBOIH-UHFFFAOYSA-N
- LogP
- 4.8641
- TPSA
- 123.85
Names and synonyms
- regorafenib monohydrate
- Regorafenib hydrate
- Regorafenib
- Stivarga
- 1019206-88-2
- Regorafenib (monohydrate)
- Stivarga (TN)
- Regorafenib hydrate [JAN]
- RefChem:57912
- UNII-MGN125FS9D
- BAY 73-4506 monohydrate
- MGN125FS9D
- REGORAFENIB [USAN]
- C21H17ClF4N4O4
- Regorafenib hydrate (JAN)
- Regorafenib monohydrate CRS
- BAY-734506 monohydrate
- MFCD17170366
- REGORAFENIB [USP-RS]
- ZOPOQLDXFHBOIH-UHFFFAOYSA-N
- orb1307433
- SCHEMBL2554008
- SCHEMBL29496390
- CHEBI:68646
- KS-00000TOW
- AMY9175
- BAY 73-4506 (monohydrate)
- C21H15ClF4N4O3.H2O
- DTXSID70144349
- REGORAFENIB [ORANGE BOOK]