N-[(1-benzyl-1H-pyrrol-2-yl)methyl]-N'-[3-(methylsulfanyl)phenyl]urea
Chemical Structure Depiction of
N-[(1-benzyl-1H-pyrrol-2-yl)methyl]-N'-[3-(methylsulfanyl)phenyl]urea
N-[(1-benzyl-1H-pyrrol-2-yl)methyl]-N'-[3-(methylsulfanyl)phenyl]urea
Compound characteristics
| Compound ID: | G331-0073 |
| Compound Name: | N-[(1-benzyl-1H-pyrrol-2-yl)methyl]-N'-[3-(methylsulfanyl)phenyl]urea |
| Molecular Weight: | 351.47 |
| Molecular Formula: | C20 H21 N3 O S |
| Smiles: | CSc1cccc(c1)NC(NCc1cccn1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2703 |
| logD: | 4.2703 |
| logSw: | -4.3205 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.934 |
| InChI Key: | PACWCONECVQJCJ-UHFFFAOYSA-N |