N~2~-(2,4-dimethoxyphenyl)-6-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~-(2,4-dimethoxyphenyl)-6-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine
N~2~-(2,4-dimethoxyphenyl)-6-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | Y020-8694 |
| Compound Name: | N~2~-(2,4-dimethoxyphenyl)-6-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 466.54 |
| Molecular Formula: | C20 H18 N8 O2 S2 |
| Smiles: | COc1ccc(c(c1)OC)Nc1nc(CSc2nnc3n2c2ccccc2s3)nc(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0163 |
| logD: | 4.0129 |
| logSw: | -4.3638 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.153 |
| InChI Key: | HTYWLDPRNHQBHZ-UHFFFAOYSA-N |