2-(2,4-dimethoxyanilino)-7H,10H-[1,3]dioxolo[4,5-g][1,3,4]thiadiazolo[2,3-b]quinazolin-10-one
Chemical Structure Depiction of
2-(2,4-dimethoxyanilino)-7H,10H-[1,3]dioxolo[4,5-g][1,3,4]thiadiazolo[2,3-b]quinazolin-10-one
2-(2,4-dimethoxyanilino)-7H,10H-[1,3]dioxolo[4,5-g][1,3,4]thiadiazolo[2,3-b]quinazolin-10-one
Compound characteristics
| Compound ID: | C200-3045 |
| Compound Name: | 2-(2,4-dimethoxyanilino)-7H,10H-[1,3]dioxolo[4,5-g][1,3,4]thiadiazolo[2,3-b]quinazolin-10-one |
| Molecular Weight: | 398.4 |
| Molecular Formula: | C18 H14 N4 O5 S |
| Smiles: | COc1ccc(c(c1)OC)NC1=NN2C(=Nc3cc4c(cc3C2=O)OCO4)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.4757 |
| logD: | 3.2976 |
| logSw: | -3.9148 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.459 |
| InChI Key: | SSPKCSYCZYYFDM-UHFFFAOYSA-N |