2-(2-{[(3-chlorophenyl)methyl]amino}-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-(2-{[(3-chlorophenyl)methyl]amino}-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-(2-{[(3-chlorophenyl)methyl]amino}-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0155 |
| Compound Name: | 2-(2-{[(3-chlorophenyl)methyl]amino}-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 320.77 |
| Molecular Formula: | C16 H17 Cl N2 O3 |
| Smiles: | Cc1cn(C)c(CC(NCc2cccc(c2)[Cl])=O)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.264 |
| logD: | 0.4648 |
| logSw: | -3.1627 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.413 |
| InChI Key: | ILANOUSEDXKQNB-UHFFFAOYSA-N |