ethyl 1,3,5-trimethyl-4-{3-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-3-oxopropyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1,3,5-trimethyl-4-{3-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-3-oxopropyl}-1H-pyrrole-2-carboxylate
ethyl 1,3,5-trimethyl-4-{3-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-3-oxopropyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0813 |
| Compound Name: | ethyl 1,3,5-trimethyl-4-{3-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-3-oxopropyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 453.63 |
| Molecular Formula: | C27 H39 N3 O3 |
| Smiles: | CCOC(c1c(C)c(CCC(NCC2CCN(CC2)Cc2ccc(C)cc2)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7056 |
| logD: | 0.9846 |
| logSw: | -3.8673 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.733 |
| InChI Key: | DQDDSNKMEHUCEQ-UHFFFAOYSA-N |