methyl 4-[N-(benzenesulfonyl)-N-propylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(benzenesulfonyl)-N-propylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(benzenesulfonyl)-N-propylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V006-0704 |
| Compound Name: | methyl 4-[N-(benzenesulfonyl)-N-propylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 392.47 |
| Molecular Formula: | C19 H24 N2 O5 S |
| Smiles: | CCCN(CC(c1c(C)c(C(=O)OC)[nH]c1C)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8989 |
| logD: | 2.8989 |
| logSw: | -3.4236 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.994 |
| InChI Key: | OMWJOAFFJSDCEB-UHFFFAOYSA-N |