2-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl}ethyl benzoate
Chemical Structure Depiction of
2-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl}ethyl benzoate
2-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl}ethyl benzoate
Compound characteristics
Compound ID: | 2994-5763 |
Compound Name: | 2-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl}ethyl benzoate |
Molecular Weight: | 347.44 |
Molecular Formula: | C16 H21 N5 O2 S |
Smiles: | CCNc1nc(NCC)nc(n1)SCCOC(c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.1525 |
logD: | 4.1525 |
logSw: | -4.0327 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.135 |
InChI Key: | MUODJIXOHLXKDE-UHFFFAOYSA-N |