7-chloro-2-(4-ethoxyanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
7-chloro-2-(4-ethoxyanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
7-chloro-2-(4-ethoxyanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | C200-6387 |
| Compound Name: | 7-chloro-2-(4-ethoxyanilino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 372.83 |
| Molecular Formula: | C17 H13 Cl N4 O2 S |
| Smiles: | CCOc1ccc(cc1)NC1=NN2C(=Nc3ccc(cc3C2=O)[Cl])S1 |
| Stereo: | ACHIRAL |
| logP: | 4.1513 |
| logD: | 4.1431 |
| logSw: | -4.4603 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.99 |
| InChI Key: | MERWGQNQUKHRMM-UHFFFAOYSA-N |