8-chloro-2-(4-nitrobenzoyl)-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one
Chemical Structure Depiction of
8-chloro-2-(4-nitrobenzoyl)-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one
8-chloro-2-(4-nitrobenzoyl)-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one
Compound characteristics
| Compound ID: | 5728-0517 |
| Compound Name: | 8-chloro-2-(4-nitrobenzoyl)-5H-[1,3,4]thiadiazolo[3,2-a]quinazolin-5-one |
| Molecular Weight: | 386.77 |
| Molecular Formula: | C16 H7 Cl N4 O4 S |
| Smiles: | c1cc(ccc1C(C1=NN2C(=NC(c3ccc(cc23)[Cl])=O)S1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1989 |
| logD: | 3.1989 |
| logSw: | -3.9279 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.388 |
| InChI Key: | ZEIXKDZFQIQDGG-UHFFFAOYSA-N |