dimethyl 2,2'-{[6-(diphenylamino)-1,3,5-triazine-2,4-diyl]bis(sulfanediyl)}diacetate
Chemical Structure Depiction of
dimethyl 2,2'-{[6-(diphenylamino)-1,3,5-triazine-2,4-diyl]bis(sulfanediyl)}diacetate
dimethyl 2,2'-{[6-(diphenylamino)-1,3,5-triazine-2,4-diyl]bis(sulfanediyl)}diacetate
Compound characteristics
| Compound ID: | 8013-2838 |
| Compound Name: | dimethyl 2,2'-{[6-(diphenylamino)-1,3,5-triazine-2,4-diyl]bis(sulfanediyl)}diacetate |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C21 H20 N4 O4 S2 |
| Smiles: | COC(CSc1nc(nc(n1)SCC(=O)OC)N(c1ccccc1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9632 |
| logD: | 3.9632 |
| logSw: | -4.1176 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 69.309 |
| InChI Key: | NSGQWWWAHHWLKO-UHFFFAOYSA-N |