4-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}pyridin-2-yl)-N-(2-chloro-5-methylphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}pyridin-2-yl)-N-(2-chloro-5-methylphenyl)piperazine-1-carboxamide
4-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}pyridin-2-yl)-N-(2-chloro-5-methylphenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V008-8075 |
| Compound Name: | 4-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}pyridin-2-yl)-N-(2-chloro-5-methylphenyl)piperazine-1-carboxamide |
| Molecular Weight: | 507.98 |
| Molecular Formula: | C26 H26 Cl N5 O4 |
| Salt: | not_available |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1C(Nc1cc(C)ccc1[Cl])=O)c1c(cccn1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2901 |
| logD: | 4.2896 |
| logSw: | -4.4998 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.78 |
| InChI Key: | QGICEVSXLUCJJQ-UHFFFAOYSA-N |