methyl 3-[(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzoate
Chemical Structure Depiction of
methyl 3-[(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzoate
methyl 3-[(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzoate
Compound characteristics
| Compound ID: | F127-0166 |
| Compound Name: | methyl 3-[(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzoate |
| Molecular Weight: | 366.4 |
| Molecular Formula: | C18 H14 N4 O3 S |
| Smiles: | Cc1ccc2c(c1)C(N1C(=N2)SC(Nc2cccc(c2)C(=O)OC)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7793 |
| logD: | 3.7647 |
| logSw: | -3.9815 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.041 |
| InChI Key: | GCIACPACTDENND-UHFFFAOYSA-N |