ethyl 3-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]benzoate
Chemical Structure Depiction of
ethyl 3-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]benzoate
ethyl 3-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]benzoate
Compound characteristics
| Compound ID: | G331-0579 |
| Compound Name: | ethyl 3-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]benzoate |
| Molecular Weight: | 411.89 |
| Molecular Formula: | C22 H22 Cl N3 O3 |
| Smiles: | CCOC(c1cccc(c1)NC(NCc1cccn1Cc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1861 |
| logD: | 5.1861 |
| logSw: | -5.6725 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.688 |
| InChI Key: | MDLXQOSUQBSWNZ-UHFFFAOYSA-N |