2-anilino-N-(3-chloro-4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-anilino-N-(3-chloro-4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-anilino-N-(3-chloro-4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | K284-7828 |
| Compound Name: | 2-anilino-N-(3-chloro-4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 477.93 |
| Molecular Formula: | C23 H16 Cl N5 O3 S |
| Smiles: | COc1ccc(cc1[Cl])NC(c1ccc2C(N3C(=Nc2c1)SC(Nc1ccccc1)=N3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3455 |
| logD: | 4.325 |
| logSw: | -4.6341 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.588 |
| InChI Key: | ONYVLBHHCQQDQC-UHFFFAOYSA-N |