N-{[1-(4-chloro-2-methoxybenzoyl)piperidin-3-yl]methyl}but-2-ynamide
Chemical Structure Depiction of
N-{[1-(4-chloro-2-methoxybenzoyl)piperidin-3-yl]methyl}but-2-ynamide
N-{[1-(4-chloro-2-methoxybenzoyl)piperidin-3-yl]methyl}but-2-ynamide
Compound characteristics
| Compound ID: | T002-5329 |
| Compound Name: | N-{[1-(4-chloro-2-methoxybenzoyl)piperidin-3-yl]methyl}but-2-ynamide |
| Molecular Weight: | 348.83 |
| Molecular Formula: | C18 H21 Cl N2 O3 |
| Smiles: | CC#CC(NCC1CCCN(C1)C(c1ccc(cc1OC)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9982 |
| logD: | 2.9982 |
| logSw: | -3.5003 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.922 |
| InChI Key: | PNTWNNJHADBPOO-CYBMUJFWSA-N |