N-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-(pyridin-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-(pyridin-2-yl)piperazine-1-carboxamide
N-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-(pyridin-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y044-5540 |
| Compound Name: | N-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-(pyridin-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C20 H24 Cl N5 O3 |
| Smiles: | C[C@@H](C(Nc1ccc(c(c1)[Cl])OC)=O)NC(N1CCN(CC1)c1ccccn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.1434 |
| logD: | 3.1343 |
| logSw: | -3.473 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.958 |
| InChI Key: | QLPARBVMAGEBIE-AWEZNQCLSA-N |