N-benzyl-2-(2,5-dimethylanilino)-N-methyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-benzyl-2-(2,5-dimethylanilino)-N-methyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
N-benzyl-2-(2,5-dimethylanilino)-N-methyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E796-0324 |
| Compound Name: | N-benzyl-2-(2,5-dimethylanilino)-N-methyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C26 H23 N5 O2 S |
| Smiles: | Cc1ccc(C)c(c1)NC1=NN2C(=Nc3cc(ccc3C2=O)C(N(C)Cc2ccccc2)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.1613 |
| logD: | 4.1511 |
| logSw: | -4.2253 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.319 |
| InChI Key: | DWNPKOGTQAIIGU-UHFFFAOYSA-N |