ethyl 4-[2-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzoate
ethyl 4-[2-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzoate
Compound characteristics
| Compound ID: | 8003-2304 |
| Compound Name: | ethyl 4-[2-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)hydrazinyl]benzoate |
| Molecular Weight: | 320.32 |
| Molecular Formula: | C13 H12 N4 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NN=C1C(NC(NC1=O)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4833 |
| logD: | 2.1476 |
| logSw: | -2.8254 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.354 |
| InChI Key: | QFMXDCRJVYJMGY-UHFFFAOYSA-N |