ethyl 4-[(8-chloro-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(8-chloro-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzoate
ethyl 4-[(8-chloro-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzoate
Compound characteristics
| Compound ID: | F127-0230 |
| Compound Name: | ethyl 4-[(8-chloro-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzoate |
| Molecular Weight: | 400.84 |
| Molecular Formula: | C18 H13 Cl N4 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC1=NN2C(=Nc3cc(ccc3C2=O)[Cl])S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2853 |
| logD: | 4.1348 |
| logSw: | -4.4887 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.62 |
| InChI Key: | WAYMJFHKBYSKEY-UHFFFAOYSA-N |