ethyl 2-({[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamamido)benzoate
Chemical Structure Depiction of
ethyl 2-({[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamamido)benzoate
ethyl 2-({[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamamido)benzoate
Compound characteristics
| Compound ID: | E983-1705 |
| Compound Name: | ethyl 2-({[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamamido)benzoate |
| Molecular Weight: | 425.91 |
| Molecular Formula: | C23 H24 Cl N3 O3 |
| Smiles: | CCOC(c1ccccc1NC(NCc1cc(C)n(c2cccc(c2)[Cl])c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8077 |
| logD: | 4.8068 |
| logSw: | -4.7607 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.584 |
| InChI Key: | OQRGPGCVBBTOEA-UHFFFAOYSA-N |