1-ethyl-2-{2-[({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)amino]-2-oxoethyl}-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-ethyl-2-{2-[({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)amino]-2-oxoethyl}-4-methyl-1H-pyrrole-3-carboxylic acid
1-ethyl-2-{2-[({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)amino]-2-oxoethyl}-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0482 |
| Compound Name: | 1-ethyl-2-{2-[({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)amino]-2-oxoethyl}-4-methyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C23 H30 F N3 O3 |
| Smiles: | CCn1cc(C)c(C(O)=O)c1CC(NCC1CCN(CC1)Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.437 |
| logD: | 2.437 |
| logSw: | -2.4101 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.315 |
| InChI Key: | XYPCTLHRNHNXEP-UHFFFAOYSA-N |