methyl 5-({4-[2-(cyclohexylamino)-2-oxoethoxy]phenyl}methylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-({4-[2-(cyclohexylamino)-2-oxoethoxy]phenyl}methylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 5-({4-[2-(cyclohexylamino)-2-oxoethoxy]phenyl}methylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2809 |
| Compound Name: | methyl 5-({4-[2-(cyclohexylamino)-2-oxoethoxy]phenyl}methylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C22 H26 N2 O5 |
| Smiles: | CC1=C(C(/C(=C/c2ccc(cc2)OCC(NC2CCCCC2)=O)N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.078 |
| logD: | 2.9117 |
| logSw: | -3.36 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.909 |
| InChI Key: | ROTFTAKQGPUWFD-UHFFFAOYSA-N |