4-(4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl)-1,3-phenylene diacetate
Chemical Structure Depiction of
4-(4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl)-1,3-phenylene diacetate
4-(4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl)-1,3-phenylene diacetate
Compound characteristics
| Compound ID: | 8007-3742 |
| Compound Name: | 4-(4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl)-1,3-phenylene diacetate |
| Molecular Weight: | 350.43 |
| Molecular Formula: | C17 H22 N2 O4 S |
| Smiles: | CC(=O)Oc1ccc(c(c1)OC(C)=O)C1(C)CC(C)(C)NC(N1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2404 |
| logD: | 2.2404 |
| logSw: | -3.1249 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.358 |
| InChI Key: | VRBHUQRIIFZWGJ-KRWDZBQOSA-N |