Primary record
Emricasan
- CAS
- 254750-02-2
- PubChem CID
- 12000240
- SMILES
- C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)COC1=C(C(=CC(=C1F)F)F)F)NC(=O)C(=O)NC2=CC=CC=C2C(C)(C)C
- Molecular Formula
- C26H27F4N3O7
- Molecular Weight
- 569.508
- Exact Mass
- 569.1785
- InChI
- InChI=1S/C26H27F4N3O7/c1-12(31-24(38)25(39)32-16-8-6-5-7-13(16)26(2,3)4)23(37)33-17(10-19(35)36)18(34)11-40-22-20(29)14(27)9-15(28)21(22)30/h5-9,12,17H,10-11H2,1-4H3,(H,31,38)(H,32,39)(H,33,37)(H,35,36)/t12-,17-/m0/s1
- InChIKey
- SCVHJVCATBPIHN-SJCJKPOMSA-N
- LogP
- 2.5913
- TPSA
- 150.9
Names and synonyms
- Emricasan
- 254750-02-2
- emricasanum
- Emricasan?
- IDN-6556
- Emricasan [USAN]
- Emricasan [USAN:INN]
- P0GMS9N47Q
- VAY785
- C26H27F4N3O7
- EMRICASAN [INN]
- UNII-P0GMS9N47Q
- Emricasan(IDN6556)
- PF-03491390
- Emricasan (USAN/INN)
- RefChem:590768
- VAY-785
- D04NAQ
- IDN 6556
- EMRICASAN [WHO-DD]
- MFCD11840420
- PF 03491390
- DTXSID10180160
- CHEMBL197672
- GTPL6508
- orb1300430
- SCHEMBL3288801
- SCHEMBL29714117
- DTXCID20102651
- IDN6556