ethyl 1-{3-[(butan-2-yl)carbamoyl]phenyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[(butan-2-yl)carbamoyl]phenyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-{3-[(butan-2-yl)carbamoyl]phenyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | K906-1964 |
Compound Name: | ethyl 1-{3-[(butan-2-yl)carbamoyl]phenyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
Molecular Weight: | 404.51 |
Molecular Formula: | C25 H28 N2 O3 |
Smiles: | CCC(C)NC(c1cccc(c1)n1c(cc(C(=O)OCC)c1C)c1ccccc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.0339 |
logD: | 5.0339 |
logSw: | -4.5908 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.541 |
InChI Key: | DJNQTKZXLKYLRZ-KRWDZBQOSA-N |