Primary record
PRN694
- CAS
- 1575818-46-0
- PubChem CID
- 90044055
- SMILES
- C[C@@H](C(C)(C)C)NCC1=CC2=C(C=C1)N(C(=N2)NC(=O)C3=CC=C(S3)C(F)F)C[C@H]4CCCN4C(=O)C=C
- Molecular Formula
- C28H35F2N5O2S
- Molecular Weight
- 543.684
- Exact Mass
- 543.248
- InChI
- InChI=1S/C28H35F2N5O2S/c1-6-24(36)34-13-7-8-19(34)16-35-21-10-9-18(15-31-17(2)28(3,4)5)14-20(21)32-27(35)33-26(37)23-12-11-22(38-23)25(29)30/h6,9-12,14,17,19,25,31H,1,7-8,13,15-16H2,2-5H3,(H,32,33,37)/t17-,19+/m0/s1
- InChIKey
- NXTKFBGDLDPFLB-PKOBYXMFSA-N
- LogP
- 5.9889
- TPSA
- 79.26
Names and synonyms
- PRN694
- 1575818-46-0
- K5IZ54DF9G
- PRN-694
- RefChem:176038
- UNII-K5IZ54DF9G
- CHEMBL4541397
- MFCD28963888
- GTPL9285
- orb1706766
- C28H35F2N5O2S
- SCHEMBL15574136
- SCHEMBL20767489
- SCHEMBL20767490
- PRN 694
- NXTKFBGDLDPFLB-PKOBYXMFSA-N
- US9573958, Compound 59
- BDBM290224
- BDBM50537959
- EX-A10684
- MFCD28952814
- AKOS040742449
- ZINC146033937
- DA-77070
- HY-12680
- MS-29999
- CS-0012239
- N-(1-(((R)-1-Acryloylpyrrolidin-2-yl)methyl)-5-((((S)-3,3-dimethylbutan-2-yl)amino)methyl)-1H-benzo[d]imidazol-2-yl)-5-(difluoromethyl)thiophene-2-carboxamide
- G14563
- A929153