2-(4-bromoanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-(4-bromoanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-(4-bromoanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | K284-2357 |
| Compound Name: | 2-(4-bromoanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 373.23 |
| Molecular Formula: | C15 H9 Br N4 O S |
| Smiles: | c1ccc2c(c1)C(N1C(=N2)SC(Nc2ccc(cc2)[Br])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7085 |
| logD: | 3.5238 |
| logSw: | -4.2428 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.867 |
| InChI Key: | YBWDWPGAHASYMP-UHFFFAOYSA-N |