N~2~,N~2~,N~4~-triethyl-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~-triethyl-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~-triethyl-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | D441-0003 |
| Compound Name: | N~2~,N~2~,N~4~-triethyl-6-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 414.53 |
| Molecular Formula: | C19 H26 N8 O S |
| Smiles: | CCNc1nc(nc(n1)n1cnc(n1)SCCOc1ccccc1)N(CC)CC |
| Stereo: | ACHIRAL |
| logP: | 4.8993 |
| logD: | 4.8978 |
| logSw: | -4.5939 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.769 |
| InChI Key: | OEWMRFFNFQEQCR-UHFFFAOYSA-N |