4-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]-N-{[4-(propan-2-yl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]-N-{[4-(propan-2-yl)phenyl]methyl}benzamide
4-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]-N-{[4-(propan-2-yl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | C200-8878 |
| Compound Name: | 4-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]-N-{[4-(propan-2-yl)phenyl]methyl}benzamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C26 H23 N5 O2 S |
| Smiles: | CC(C)c1ccc(CNC(c2ccc(cc2)NC2=NN3C(=Nc4ccccc4C3=O)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7098 |
| logD: | 4.3461 |
| logSw: | -4.4043 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.28 |
| InChI Key: | UIZOJMWYMOXIIB-UHFFFAOYSA-N |