N-({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-[3-(methylsulfanyl)phenyl]urea
Chemical Structure Depiction of
N-({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-[3-(methylsulfanyl)phenyl]urea
N-({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-[3-(methylsulfanyl)phenyl]urea
Compound characteristics
| Compound ID: | G331-0389 |
| Compound Name: | N-({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-[3-(methylsulfanyl)phenyl]urea |
| Molecular Weight: | 379.52 |
| Molecular Formula: | C22 H25 N3 O S |
| Smiles: | Cc1ccc(C)c(Cn2cccc2CNC(Nc2cccc(c2)SC)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.4809 |
| logD: | 5.4809 |
| logSw: | -5.2904 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.934 |
| InChI Key: | BJJDLCIISYSDQT-UHFFFAOYSA-N |