methyl (1-{N-[4-(3-chlorophenyl)piperazine-1-carbonyl]-L-alanyl}piperidin-4-yl)acetate
Chemical Structure Depiction of
methyl (1-{N-[4-(3-chlorophenyl)piperazine-1-carbonyl]-L-alanyl}piperidin-4-yl)acetate
methyl (1-{N-[4-(3-chlorophenyl)piperazine-1-carbonyl]-L-alanyl}piperidin-4-yl)acetate
Compound characteristics
| Compound ID: | Y043-6778 |
| Compound Name: | methyl (1-{N-[4-(3-chlorophenyl)piperazine-1-carbonyl]-L-alanyl}piperidin-4-yl)acetate |
| Molecular Weight: | 450.96 |
| Molecular Formula: | C22 H31 Cl N4 O4 |
| Smiles: | C[C@@H](C(N1CCC(CC1)CC(=O)OC)=O)NC(N1CCN(CC1)c1cccc(c1)[Cl])=O |
| Stereo: | ABSOLUTE |
| logP: | 2.6028 |
| logD: | 2.6025 |
| logSw: | -3.4542 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.952 |
| InChI Key: | CQICXURPMBTJFA-INIZCTEOSA-N |