2-(3-chloro-2-methylanilino)-N-[2-(diethylamino)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(3-chloro-2-methylanilino)-N-[2-(diethylamino)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(3-chloro-2-methylanilino)-N-[2-(diethylamino)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E796-0444 |
| Compound Name: | 2-(3-chloro-2-methylanilino)-N-[2-(diethylamino)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 485.01 |
| Molecular Formula: | C23 H25 Cl N6 O2 S |
| Smiles: | CCN(CC)CCNC(c1ccc2C(N3C(=Nc2c1)SC(Nc1cccc(c1C)[Cl])=N3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0045 |
| logD: | 4.0045 |
| logSw: | -4.3938 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.106 |
| InChI Key: | JGEYVPMVSFXZQU-UHFFFAOYSA-N |