2-(5-chloro-2-methylanilino)-N-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(5-chloro-2-methylanilino)-N-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(5-chloro-2-methylanilino)-N-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E796-0429 |
| Compound Name: | 2-(5-chloro-2-methylanilino)-N-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 425.89 |
| Molecular Formula: | C20 H16 Cl N5 O2 S |
| Smiles: | Cc1ccc(cc1NC1=NN2C(=Nc3cc(ccc3C2=O)C(NC2CC2)=O)S1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3838 |
| logD: | 3.0614 |
| logSw: | -3.9463 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.639 |
| InChI Key: | ASDPETAVGHXMHS-UHFFFAOYSA-N |