N-{[4-(4-methylphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]methyl}-N'-(naphthalen-1-yl)urea
Chemical Structure Depiction of
N-{[4-(4-methylphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]methyl}-N'-(naphthalen-1-yl)urea
N-{[4-(4-methylphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]methyl}-N'-(naphthalen-1-yl)urea
Compound characteristics
| Compound ID: | V008-3189 |
| Compound Name: | N-{[4-(4-methylphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]methyl}-N'-(naphthalen-1-yl)urea |
| Molecular Weight: | 493.63 |
| Molecular Formula: | C29 H27 N5 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c(CNC(Nc2cccc3ccccc23)=O)nnc1SCc1ccccc1C |
| Stereo: | ACHIRAL |
| logP: | 6.1906 |
| logD: | 6.1906 |
| logSw: | -6.6377 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.616 |
| InChI Key: | WXGQSFXPZRGSAZ-UHFFFAOYSA-N |