N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4-(pyrimidin-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4-(pyrimidin-2-yl)piperazine-1-carboxamide
N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4-(pyrimidin-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y043-6460 |
| Compound Name: | N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4-(pyrimidin-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 404.85 |
| Molecular Formula: | C18 H21 Cl N6 O3 |
| Smiles: | COc1ccc(cc1NC(CNC(N1CCN(CC1)c1ncccn1)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.0823 |
| logD: | 2.0802 |
| logSw: | -3.0506 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.734 |
| InChI Key: | UEQXJUOCKGVAAU-UHFFFAOYSA-N |