methyl 2-[(1-acetylpiperidin-4-yl)(propan-2-yl)carbamamido]-4-chlorobenzoate
Chemical Structure Depiction of
methyl 2-[(1-acetylpiperidin-4-yl)(propan-2-yl)carbamamido]-4-chlorobenzoate
methyl 2-[(1-acetylpiperidin-4-yl)(propan-2-yl)carbamamido]-4-chlorobenzoate
Compound characteristics
| Compound ID: | E002-1603 |
| Compound Name: | methyl 2-[(1-acetylpiperidin-4-yl)(propan-2-yl)carbamamido]-4-chlorobenzoate |
| Molecular Weight: | 395.88 |
| Molecular Formula: | C19 H26 Cl N3 O4 |
| Smiles: | CC(C)N(C1CCN(CC1)C(C)=O)C(Nc1cc(ccc1C(=O)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2115 |
| logD: | 3.2036 |
| logSw: | -3.6279 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.038 |
| InChI Key: | CBUSMYIRNKCWAB-UHFFFAOYSA-N |