methyl 4-[N-(benzenesulfonyl)-N-(3-methoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(benzenesulfonyl)-N-(3-methoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(benzenesulfonyl)-N-(3-methoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V025-2661 |
| Compound Name: | methyl 4-[N-(benzenesulfonyl)-N-(3-methoxypropyl)alanyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 450.55 |
| Molecular Formula: | C22 H30 N2 O6 S |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)n(C)c1C)=O)N(CCCOC)S(c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4575 |
| logD: | 2.4575 |
| logSw: | -2.614 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 77.058 |
| InChI Key: | WOOKBAGRHHALDY-KRWDZBQOSA-N |