methyl 4-[N-(benzenesulfonyl)-N-(3-methoxypropyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(benzenesulfonyl)-N-(3-methoxypropyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(benzenesulfonyl)-N-(3-methoxypropyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-4274 |
| Compound Name: | methyl 4-[N-(benzenesulfonyl)-N-(3-methoxypropyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C21 H28 N2 O6 S |
| Smiles: | Cc1c(C(CN(CCCOC)S(c2ccccc2)(=O)=O)=O)c(C)n(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0842 |
| logD: | 2.0842 |
| logSw: | -2.5432 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 76.164 |
| InChI Key: | HLKYEZAAUYLRJN-UHFFFAOYSA-N |