2-(benzylamino)-N-[(4-chlorophenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(benzylamino)-N-[(4-chlorophenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(benzylamino)-N-[(4-chlorophenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | C200-3931 |
| Compound Name: | 2-(benzylamino)-N-[(4-chlorophenyl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 475.96 |
| Molecular Formula: | C24 H18 Cl N5 O2 S |
| Smiles: | C(c1ccccc1)NC1=NN2C(=Nc3cc(ccc3C2=O)C(NCc2ccc(cc2)[Cl])=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.7871 |
| logD: | 3.7683 |
| logSw: | -4.457 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.602 |
| InChI Key: | NJQJSZGIAJPPNP-UHFFFAOYSA-N |