7-chloro-2-(3-methoxyanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
7-chloro-2-(3-methoxyanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
7-chloro-2-(3-methoxyanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | C200-6385 |
| Compound Name: | 7-chloro-2-(3-methoxyanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 358.8 |
| Molecular Formula: | C16 H11 Cl N4 O2 S |
| Smiles: | COc1cccc(c1)NC1=NN2C(=Nc3ccc(cc3C2=O)[Cl])S1 |
| Stereo: | ACHIRAL |
| logP: | 3.8488 |
| logD: | 3.8149 |
| logSw: | -4.3602 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.41 |
| InChI Key: | HQXZWWQFCCDQRK-UHFFFAOYSA-N |