2-(5-chloro-2-methylanilino)-N-(3-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(5-chloro-2-methylanilino)-N-(3-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(5-chloro-2-methylanilino)-N-(3-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E796-0411 |
| Compound Name: | 2-(5-chloro-2-methylanilino)-N-(3-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 491.95 |
| Molecular Formula: | C24 H18 Cl N5 O3 S |
| Smiles: | Cc1ccc(cc1NC1=NN2C(=Nc3cc(ccc3C2=O)C(Nc2cccc(c2)OC)=O)S1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8386 |
| logD: | 4.5163 |
| logSw: | -4.9121 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.804 |
| InChI Key: | JZCQKGKCRIFZRK-UHFFFAOYSA-N |