2-anilino-N-[(4-chlorophenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-anilino-N-[(4-chlorophenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-anilino-N-[(4-chlorophenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | K284-7817 |
| Compound Name: | 2-anilino-N-[(4-chlorophenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 461.93 |
| Molecular Formula: | C23 H16 Cl N5 O2 S |
| Smiles: | C(c1ccc(cc1)[Cl])NC(c1ccc2C(N3C(=Nc2c1)SC(Nc1ccccc1)=N3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0955 |
| logD: | 4.0908 |
| logSw: | -4.6068 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.28 |
| InChI Key: | IZDOWWIHEPQVLE-UHFFFAOYSA-N |