N~2~,N~2~,N~4~-trimethyl-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~,N~2~,N~4~-trimethyl-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazine-2,4-diamine
N~2~,N~2~,N~4~-trimethyl-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | D441-0001 |
| Compound Name: | N~2~,N~2~,N~4~-trimethyl-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 372.45 |
| Molecular Formula: | C16 H20 N8 O S |
| Smiles: | CNc1nc(nc(n1)n1cnc(n1)SCCOc1ccccc1)N(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.3638 |
| logD: | 3.3443 |
| logSw: | -3.6609 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.362 |
| InChI Key: | RLSQSFLPGJTGDR-UHFFFAOYSA-N |