2-(2-methylanilino)-5-oxo-N-[(thiophen-2-yl)methyl]-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(2-methylanilino)-5-oxo-N-[(thiophen-2-yl)methyl]-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(2-methylanilino)-5-oxo-N-[(thiophen-2-yl)methyl]-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | K284-7803 |
| Compound Name: | 2-(2-methylanilino)-5-oxo-N-[(thiophen-2-yl)methyl]-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 447.54 |
| Molecular Formula: | C22 H17 N5 O2 S2 |
| Smiles: | Cc1ccccc1NC1=NN2C(=Nc3cc(ccc3C2=O)C(NCc2cccs2)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.7508 |
| logD: | 3.7432 |
| logSw: | -3.9835 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.601 |
| InChI Key: | UBPGUCKTEVOXNM-UHFFFAOYSA-N |