2-(2-methoxyanilino)-N-[(3-methoxyphenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(2-methoxyanilino)-N-[(3-methoxyphenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(2-methoxyanilino)-N-[(3-methoxyphenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E796-0206 |
| Compound Name: | 2-(2-methoxyanilino)-N-[(3-methoxyphenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 487.54 |
| Molecular Formula: | C25 H21 N5 O4 S |
| Smiles: | COc1cccc(CNC(c2ccc3C(N4C(=Nc3c2)SC(Nc2ccccc2OC)=N4)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8313 |
| logD: | 3.7351 |
| logSw: | -4.0657 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.756 |
| InChI Key: | LANRDNPHHJUXSR-UHFFFAOYSA-N |