Primary record
Rociletinib
- CAS
- 1374640-70-6
- PubChem CID
- 57335384
- SMILES
- CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC(=CC=C4)NC(=O)C=C)C(F)(F)F)OC
- Molecular Formula
- C27H28F3N7O3
- Molecular Weight
- 555.561
- Exact Mass
- 555.2206
- InChI
- InChI=1S/C27H28F3N7O3/c1-4-24(39)32-18-6-5-7-19(14-18)33-25-21(27(28,29)30)16-31-26(35-25)34-22-9-8-20(15-23(22)40-3)37-12-10-36(11-13-37)17(2)38/h4-9,14-16H,1,10-13H2,2-3H3,(H,32,39)(H2,31,33,34,35)
- InChIKey
- HUFOZJXAKZVRNJ-UHFFFAOYSA-N
- LogP
- 4.7842
- TPSA
- 111.72
Names and synonyms
- Rociletinib
- CO-1686
- 1374640-70-6
- rociletinibum
- AVL-301
- Rociletinib [USAN]
- Tube721
- Rociletinib [USAN:INN]
- CNX-419
- Rociletinib (CO-1686)
- RefChem:883681
- ROCILETINIB [INN]
- CO-1686(Rociletinib)
- Rociletinib (USAN/INN)
- Rociletinib; CO-1686
- D0M4AV
- CO-1686 (AVL-301)
- MFCD26793864
- ROCILETINIB [WHO-DD]
- UNII-72AH61702G
- Rociletinib (CO-1686)?
- C27H28F3N7O3
- CS-1631
- CO1686
- DTXSID801025958
- GTPL7966
- orb1305584
- SCHEMBL4177736
- 72AH61702G
- CHEMBL3545308