[(2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4,4-difluoropyrrolidin-1-yl](3,5-dimethyl-1,2-oxazol-4-yl)methanone
Chemical Structure Depiction of
[(2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4,4-difluoropyrrolidin-1-yl](3,5-dimethyl-1,2-oxazol-4-yl)methanone
[(2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4,4-difluoropyrrolidin-1-yl](3,5-dimethyl-1,2-oxazol-4-yl)methanone
Compound characteristics
| Compound ID: | CM4572-6996 |
| Compound Name: | [(2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4,4-difluoropyrrolidin-1-yl](3,5-dimethyl-1,2-oxazol-4-yl)methanone |
| Molecular Weight: | 389.4 |
| Molecular Formula: | C20 H21 F2 N3 O3 |
| Smiles: | Cc1c(C(N2CC(C[C@H]2C(N2CCc3ccccc3C2)=O)(F)F)=O)c(C)on1 |
| Stereo: | ABSOLUTE |
| logP: | 2.254 |
| logD: | 2.254 |
| logSw: | -2.4928 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.228 |
| InChI Key: | BSBPLCCDUPLWEF-MRXNPFEDSA-N |