7-bromo-2-(2,6-diethylanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
7-bromo-2-(2,6-diethylanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
7-bromo-2-(2,6-diethylanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | F127-0112 |
| Compound Name: | 7-bromo-2-(2,6-diethylanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 429.34 |
| Molecular Formula: | C19 H17 Br N4 O S |
| Smiles: | CCc1cccc(CC)c1NC1=NN2C(=Nc3ccc(cc3C2=O)[Br])S1 |
| Stereo: | ACHIRAL |
| logP: | 5.1086 |
| logD: | 5.1043 |
| logSw: | -4.9632 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.471 |
| InChI Key: | CSLCOCQUXPHPNF-UHFFFAOYSA-N |