methyl 2-({4-[(pyridin-4-yl)methyl]piperazine-1-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({4-[(pyridin-4-yl)methyl]piperazine-1-carbonyl}amino)benzoate
methyl 2-({4-[(pyridin-4-yl)methyl]piperazine-1-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | Y206-6866 |
| Compound Name: | methyl 2-({4-[(pyridin-4-yl)methyl]piperazine-1-carbonyl}amino)benzoate |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C19 H22 N4 O3 |
| Smiles: | COC(c1ccccc1NC(N1CCN(CC1)Cc1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5427 |
| logD: | 1.5077 |
| logSw: | -2.0356 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.152 |
| InChI Key: | ZBAZUIPKDBFCIN-UHFFFAOYSA-N |