N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-[3-(methylsulfanyl)phenyl]urea
Chemical Structure Depiction of
N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-[3-(methylsulfanyl)phenyl]urea
N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-[3-(methylsulfanyl)phenyl]urea
Compound characteristics
| Compound ID: | G331-0626 |
| Compound Name: | N-({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-[3-(methylsulfanyl)phenyl]urea |
| Molecular Weight: | 385.91 |
| Molecular Formula: | C20 H20 Cl N3 O S |
| Smiles: | CSc1cccc(c1)NC(NCc1cccn1Cc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.865 |
| logD: | 4.865 |
| logSw: | -4.9226 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.934 |
| InChI Key: | LBZQJEVIUKYYCS-UHFFFAOYSA-N |