methyl 1,3,5-trimethyl-4-[N-methyl-N-(4-methylbenzene-1-sulfonyl)glycyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1,3,5-trimethyl-4-[N-methyl-N-(4-methylbenzene-1-sulfonyl)glycyl]-1H-pyrrole-2-carboxylate
methyl 1,3,5-trimethyl-4-[N-methyl-N-(4-methylbenzene-1-sulfonyl)glycyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-3484 |
| Compound Name: | methyl 1,3,5-trimethyl-4-[N-methyl-N-(4-methylbenzene-1-sulfonyl)glycyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 392.47 |
| Molecular Formula: | C19 H24 N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(N(C)CC(c1c(C)c(C(=O)OC)n(C)c1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4554 |
| logD: | 2.4554 |
| logSw: | -2.6698 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.032 |
| InChI Key: | UDEQLQUBZASKPE-UHFFFAOYSA-N |