6-({[1-(2H-1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)-N~2~,N~2~-dimethyl-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
6-({[1-(2H-1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)-N~2~,N~2~-dimethyl-1,3,5-triazine-2,4-diamine
6-({[1-(2H-1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)-N~2~,N~2~-dimethyl-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | 8015-0505 |
| Compound Name: | 6-({[1-(2H-1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)-N~2~,N~2~-dimethyl-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 373.39 |
| Molecular Formula: | C14 H15 N9 O2 S |
| Smiles: | CN(C)c1nc(CSc2nnnn2c2ccc3c(c2)OCO3)nc(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9345 |
| logD: | 1.9229 |
| logSw: | -2.6754 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.059 |
| InChI Key: | IWDJIHXCZRVMEE-UHFFFAOYSA-N |