methyl 4-[N-(4-chlorobenzoyl)-N-cyclopropylglycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(4-chlorobenzoyl)-N-cyclopropylglycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(4-chlorobenzoyl)-N-cyclopropylglycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-1675 |
| Compound Name: | methyl 4-[N-(4-chlorobenzoyl)-N-cyclopropylglycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 416.9 |
| Molecular Formula: | C22 H25 Cl N2 O4 |
| Smiles: | CCn1c(C)c(C(CN(C2CC2)C(c2ccc(cc2)[Cl])=O)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9222 |
| logD: | 3.9222 |
| logSw: | -4.8678 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.897 |
| InChI Key: | XDKSAXRVLKRYJJ-UHFFFAOYSA-N |