[4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 4-methylpiperazine-1-carbodithioate
Chemical Structure Depiction of
[4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 4-methylpiperazine-1-carbodithioate
[4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 4-methylpiperazine-1-carbodithioate
Compound characteristics
| Compound ID: | 6809-0052 |
| Compound Name: | [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 4-methylpiperazine-1-carbodithioate |
| Molecular Weight: | 405.54 |
| Molecular Formula: | C17 H23 N7 O S2 |
| Smiles: | CN1CCN(CC1)C(=S)SCc1nc(N)nc(Nc2ccccc2OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.729 |
| logD: | 1.9241 |
| logSw: | -3.2411 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.838 |
| InChI Key: | FUAJKBBHNJLBKC-UHFFFAOYSA-N |