2-(5-chloro-2-methylanilino)-8-(3-methylpiperidine-1-carbonyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-(5-chloro-2-methylanilino)-8-(3-methylpiperidine-1-carbonyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-(5-chloro-2-methylanilino)-8-(3-methylpiperidine-1-carbonyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | K284-7800 |
| Compound Name: | 2-(5-chloro-2-methylanilino)-8-(3-methylpiperidine-1-carbonyl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 467.98 |
| Molecular Formula: | C23 H22 Cl N5 O2 S |
| Smiles: | CC1CCCN(C1)C(c1ccc2C(N3C(=Nc2c1)SC(Nc1cc(ccc1C)[Cl])=N3)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1045 |
| logD: | 3.7822 |
| logSw: | -4.5043 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.751 |
| InChI Key: | ONHZQAJYEFHGMT-ZDUSSCGKSA-N |