ethyl 3,5-dimethyl-4-({(2-methylbenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-({(2-methylbenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-({(2-methylbenzene-1-sulfonyl)[(oxolan-2-yl)methyl]amino}methyl)-1H-pyrrole-2-carboxylate
Compound characteristics
Compound ID: | G800-0312 |
Compound Name: | ethyl 3,5-dimethyl-4-({(2-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(c2ccccc2C)(=O)=O)c(C)[nH]1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3701 |
logD: | 3.3701 |
logSw: | -3.5744 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.732 |
InChI Key: | RHIJBQQEOIHESE-GOSISDBHSA-N |