4-(4-chlorophenyl)-N-[(2S)-3-methyl-1-oxo-1-{[(pyridin-3-yl)methyl]amino}butan-2-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-chlorophenyl)-N-[(2S)-3-methyl-1-oxo-1-{[(pyridin-3-yl)methyl]amino}butan-2-yl]piperazine-1-carboxamide
4-(4-chlorophenyl)-N-[(2S)-3-methyl-1-oxo-1-{[(pyridin-3-yl)methyl]amino}butan-2-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y044-5316 |
| Compound Name: | 4-(4-chlorophenyl)-N-[(2S)-3-methyl-1-oxo-1-{[(pyridin-3-yl)methyl]amino}butan-2-yl]piperazine-1-carboxamide |
| Molecular Weight: | 429.95 |
| Molecular Formula: | C22 H28 Cl N5 O2 |
| Smiles: | CC(C)[C@@H](C(NCc1cccnc1)=O)NC(N1CCN(CC1)c1ccc(cc1)[Cl])=O |
| Stereo: | ABSOLUTE |
| logP: | 2.4833 |
| logD: | 2.4809 |
| logSw: | -3.2386 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.845 |
| InChI Key: | HWRALHYKBOMOHS-FQEVSTJZSA-N |