ethyl 4-[N-(4-chlorobenzoyl)-N-ethylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[N-(4-chlorobenzoyl)-N-ethylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[N-(4-chlorobenzoyl)-N-ethylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V007-3734 |
| Compound Name: | ethyl 4-[N-(4-chlorobenzoyl)-N-ethylglycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 390.87 |
| Molecular Formula: | C20 H23 Cl N2 O4 |
| Smiles: | CCN(CC(c1c(C)c(C(=O)OCC)[nH]c1C)=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2617 |
| logD: | 3.2617 |
| logSw: | -4.0897 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.156 |
| InChI Key: | SSSMYIJEARNOTG-UHFFFAOYSA-N |