2-(3-chloroanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-(3-chloroanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-(3-chloroanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | F127-0030 |
| Compound Name: | 2-(3-chloroanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 328.78 |
| Molecular Formula: | C15 H9 Cl N4 O S |
| Smiles: | c1ccc2c(c1)C(N1C(=N2)SC(Nc2cccc(c2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6282 |
| logD: | 3.4139 |
| logSw: | -4.0422 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.867 |
| InChI Key: | VERRDVKZMOHZJR-UHFFFAOYSA-N |