4-(4-fluorophenyl)-N-{(2S)-1-[3-(methylsulfanyl)anilino]-1-oxopropan-2-yl}piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-fluorophenyl)-N-{(2S)-1-[3-(methylsulfanyl)anilino]-1-oxopropan-2-yl}piperazine-1-carboxamide
4-(4-fluorophenyl)-N-{(2S)-1-[3-(methylsulfanyl)anilino]-1-oxopropan-2-yl}piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y043-6708 |
| Compound Name: | 4-(4-fluorophenyl)-N-{(2S)-1-[3-(methylsulfanyl)anilino]-1-oxopropan-2-yl}piperazine-1-carboxamide |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C21 H25 F N4 O2 S |
| Smiles: | C[C@@H](C(Nc1cccc(c1)SC)=O)NC(N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.5768 |
| logD: | 3.5761 |
| logSw: | -3.8386 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.816 |
| InChI Key: | CHCVBKLHIJCLPP-HNNXBMFYSA-N |