methyl 2-(3,4-dimethylanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxylate
Chemical Structure Depiction of
methyl 2-(3,4-dimethylanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxylate
methyl 2-(3,4-dimethylanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxylate
Compound characteristics
| Compound ID: | F127-0054 |
| Compound Name: | methyl 2-(3,4-dimethylanilino)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxylate |
| Molecular Weight: | 380.42 |
| Molecular Formula: | C19 H16 N4 O3 S |
| Smiles: | Cc1ccc(cc1C)NC1=NN2C(=Nc3cc(ccc3C2=O)C(=O)OC)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.1535 |
| logD: | 4.1452 |
| logSw: | -4.3221 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.041 |
| InChI Key: | KZDWBWXOGLNARL-UHFFFAOYSA-N |