N-[(4-chlorophenyl)methyl]-2-(2-methoxyanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-(2-methoxyanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
N-[(4-chlorophenyl)methyl]-2-(2-methoxyanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E796-0183 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-(2-methoxyanilino)-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: | COc1ccccc1NC1=NN2C(=Nc3cc(ccc3C2=O)C(NCc2ccc(cc2)[Cl])=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.3288 |
| logD: | 4.2325 |
| logSw: | -4.6106 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.213 |
| InChI Key: | DHBWJLIUPRMULE-UHFFFAOYSA-N |