N~2~-(4-methoxyphenyl)-6-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~-(4-methoxyphenyl)-6-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine
N~2~-(4-methoxyphenyl)-6-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | 5645-0240 |
| Compound Name: | N~2~-(4-methoxyphenyl)-6-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 406.47 |
| Molecular Formula: | C19 H18 N8 O S |
| Smiles: | COc1ccc(cc1)Nc1nc(CSc2nnc(c3ccccc3)[nH]2)nc(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3482 |
| logD: | 2.1385 |
| logSw: | -3.7379 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 101.387 |
| InChI Key: | JFCLUEUAPRRQEM-UHFFFAOYSA-N |