methyl 4-[N-(4-methoxybenzoyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(4-methoxybenzoyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(4-methoxybenzoyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V028-0997 |
| Compound Name: | methyl 4-[N-(4-methoxybenzoyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 400.47 |
| Molecular Formula: | C22 H28 N2 O5 |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(c1c(C)c(C(=O)OC)[nH]c1C)=O)C(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1863 |
| logD: | 3.1863 |
| logSw: | -3.4598 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.396 |
| InChI Key: | BMASYTLJRRIFHM-UHFFFAOYSA-N |