methyl 4-[N-(benzenesulfonyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(benzenesulfonyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(benzenesulfonyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V028-2586 |
| Compound Name: | methyl 4-[N-(benzenesulfonyl)-N-(2-methylpropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 406.5 |
| Molecular Formula: | C20 H26 N2 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(c1c(C)c(C(=O)OC)[nH]c1C)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2988 |
| logD: | 3.2988 |
| logSw: | -3.8397 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.016 |
| InChI Key: | PVAZESBRRRMLLN-UHFFFAOYSA-N |