ethyl 4-{[(5-bromofuran-2-carbonyl)(2-phenylethyl)amino]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{[(5-bromofuran-2-carbonyl)(2-phenylethyl)amino]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{[(5-bromofuran-2-carbonyl)(2-phenylethyl)amino]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
Compound ID: | G798-0644 |
Compound Name: | ethyl 4-{[(5-bromofuran-2-carbonyl)(2-phenylethyl)amino]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
Molecular Weight: | 473.37 |
Molecular Formula: | C23 H25 Br N2 O4 |
Smiles: | CCOC(c1c(C)c(CN(CCc2ccccc2)C(c2ccc(o2)[Br])=O)c(C)[nH]1)=O |
Stereo: | ACHIRAL |
logP: | 4.7552 |
logD: | 4.7552 |
logSw: | -4.4155 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.817 |
InChI Key: | BDPIBXUBMHHCIE-UHFFFAOYSA-N |