methyl 4-{N-[(furan-2-yl)methyl]-N-(4-methoxybenzene-1-sulfonyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-[(furan-2-yl)methyl]-N-(4-methoxybenzene-1-sulfonyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-[(furan-2-yl)methyl]-N-(4-methoxybenzene-1-sulfonyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-4594 |
| Compound Name: | methyl 4-{N-[(furan-2-yl)methyl]-N-(4-methoxybenzene-1-sulfonyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C23 H26 N2 O7 S |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)[nH]c1C)=O)N(Cc1ccco1)S(c1ccc(cc1)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5019 |
| logD: | 3.5019 |
| logSw: | -3.935 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.931 |
| InChI Key: | IEBUAUYJSXXDOQ-INIZCTEOSA-N |