ethyl 1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1H-imidazole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1H-imidazole-2-carboxylate
ethyl 1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1H-imidazole-2-carboxylate
Compound characteristics
| Compound ID: | C791-0936 |
| Compound Name: | ethyl 1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1H-imidazole-2-carboxylate |
| Molecular Weight: | 321.76 |
| Molecular Formula: | C15 H16 Cl N3 O3 |
| Smiles: | CCOC(c1nccn1CC(Nc1cccc(c1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5086 |
| logD: | 2.5082 |
| logSw: | -3.0266 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.953 |
| InChI Key: | YRLUDGNZRLQBPC-UHFFFAOYSA-N |