ethyl 3,5-dimethyl-4-({(4-methylbenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-({(4-methylbenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-({(4-methylbenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G800-0292 |
| Compound Name: | ethyl 3,5-dimethyl-4-({(4-methylbenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 434.55 |
| Molecular Formula: | C22 H30 N2 O5 S |
| Smiles: | CCOC(c1c(C)c(CN(CC2CCCO2)S(c2ccc(C)cc2)(=O)=O)c(C)[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6669 |
| logD: | 3.6669 |
| logSw: | -3.6798 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.732 |
| InChI Key: | BPTSKRUXVXOMDI-GOSISDBHSA-N |