N-[(3-methoxyphenyl)methyl]-2-(2-methylanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-2-(2-methylanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
N-[(3-methoxyphenyl)methyl]-2-(2-methylanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E796-0063 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-2-(2-methylanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 471.54 |
| Molecular Formula: | C25 H21 N5 O3 S |
| Smiles: | Cc1ccccc1NC1=NN2C(=Nc3cc(ccc3C2=O)C(NCc2cccc(c2)OC)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.8731 |
| logD: | 3.8655 |
| logSw: | -4.0798 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.126 |
| InChI Key: | IIGZNPSGVVGLAV-UHFFFAOYSA-N |