(2S,4S)-N-cyclohexyl-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-fluoropyrrolidine-1-carboxamide
Chemical Structure Depiction of
(2S,4S)-N-cyclohexyl-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-fluoropyrrolidine-1-carboxamide
(2S,4S)-N-cyclohexyl-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-fluoropyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | S254-0012 |
| Compound Name: | (2S,4S)-N-cyclohexyl-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-4-fluoropyrrolidine-1-carboxamide |
| Molecular Weight: | 373.47 |
| Molecular Formula: | C21 H28 F N3 O2 |
| Smiles: | C1CCC(CC1)NC(N1C[C@H](C[C@H]1C(N1CCc2ccccc2C1)=O)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.4839 |
| logD: | 3.4839 |
| logSw: | -3.495 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.058 |
| InChI Key: | XKLHHPCJXNXUNW-PKOBYXMFSA-N |