2-(benzylamino)-N-cyclopentyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(benzylamino)-N-cyclopentyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(benzylamino)-N-cyclopentyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | C200-3994 |
| Compound Name: | 2-(benzylamino)-N-cyclopentyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C22 H21 N5 O2 S |
| Smiles: | C1CCC(C1)NC(c1ccc2C(N3C(=Nc2c1)SC(NCc1ccccc1)=N3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0697 |
| logD: | 3.051 |
| logSw: | -3.7213 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.693 |
| InChI Key: | MNKXDXKYJAEZCZ-UHFFFAOYSA-N |