2-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1H-isoindole-1,3(2H)-dione
2-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 4334-0547 |
| Compound Name: | 2-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(4-oxo-4H-3,1-benzoxazin-2-yl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 436.47 |
| Molecular Formula: | C20 H12 N4 O4 S2 |
| Smiles: | CCSc1nnc(N2C(c3ccc(cc3C2=O)C2=Nc3ccccc3C(=O)O2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.599 |
| logD: | 3.599 |
| logSw: | -3.9023 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.507 |
| InChI Key: | FGBTYIYKUWHKQZ-UHFFFAOYSA-N |