methyl 2-{(1-acetylpiperidin-4-yl)[3-(4-methylpiperidin-1-yl)propyl]carbamamido}-4-chlorobenzoate
Chemical Structure Depiction of
methyl 2-{(1-acetylpiperidin-4-yl)[3-(4-methylpiperidin-1-yl)propyl]carbamamido}-4-chlorobenzoate
methyl 2-{(1-acetylpiperidin-4-yl)[3-(4-methylpiperidin-1-yl)propyl]carbamamido}-4-chlorobenzoate
Compound characteristics
| Compound ID: | E641-3312 |
| Compound Name: | methyl 2-{(1-acetylpiperidin-4-yl)[3-(4-methylpiperidin-1-yl)propyl]carbamamido}-4-chlorobenzoate |
| Molecular Weight: | 493.05 |
| Molecular Formula: | C25 H37 Cl N4 O4 |
| Smiles: | CC1CCN(CCCN(C2CCN(CC2)C(C)=O)C(Nc2cc(ccc2C(=O)OC)[Cl])=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.8189 |
| logD: | 1.7675 |
| logSw: | -4.1835 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.876 |
| InChI Key: | TZIWEHFNLJKUPF-UHFFFAOYSA-N |