2-(5-chloro-2-methoxyanilino)-7,8-dimethoxy-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-(5-chloro-2-methoxyanilino)-7,8-dimethoxy-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-(5-chloro-2-methoxyanilino)-7,8-dimethoxy-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | F127-0309 |
| Compound Name: | 2-(5-chloro-2-methoxyanilino)-7,8-dimethoxy-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 418.86 |
| Molecular Formula: | C18 H15 Cl N4 O4 S |
| Smiles: | COc1ccc(cc1NC1=NN2C(=Nc3cc(c(cc3C2=O)OC)OC)S1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.671 |
| logD: | 2.3981 |
| logSw: | -4.102 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.06 |
| InChI Key: | MCNFGZBPUCBXOJ-UHFFFAOYSA-N |