N-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-(pyrimidin-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-(pyrimidin-2-yl)piperazine-1-carboxamide
N-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-(pyrimidin-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y043-6421 |
| Compound Name: | N-[(2S)-1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl]-4-(pyrimidin-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 418.88 |
| Molecular Formula: | C19 H23 Cl N6 O3 |
| Smiles: | C[C@@H](C(Nc1ccc(c(c1)[Cl])OC)=O)NC(N1CCN(CC1)c1ncccn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.6405 |
| logD: | 2.6401 |
| logSw: | -3.4743 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.809 |
| InChI Key: | VGFMLNMSNQLIEJ-ZDUSSCGKSA-N |