methyl 4-{N-(4-chlorobenzoyl)-N-[(furan-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-(4-chlorobenzoyl)-N-[(furan-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-(4-chlorobenzoyl)-N-[(furan-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V006-9388 |
| Compound Name: | methyl 4-{N-(4-chlorobenzoyl)-N-[(furan-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 428.87 |
| Molecular Formula: | C22 H21 Cl N2 O5 |
| Smiles: | Cc1c(C(CN(Cc2ccco2)C(c2ccc(cc2)[Cl])=O)=O)c(C)[nH]c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.4677 |
| logD: | 3.4677 |
| logSw: | -4.4592 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.329 |
| InChI Key: | FYWONNWLURSSOZ-UHFFFAOYSA-N |