2-bromo-N-{[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Chemical Structure Depiction of
2-bromo-N-{[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
2-bromo-N-{[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | 4028-0345 |
| Compound Name: | 2-bromo-N-{[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide |
| Molecular Weight: | 467.34 |
| Molecular Formula: | C21 H15 Br N4 O2 S |
| Smiles: | Cc1ccc(cc1NC(NC(c1ccccc1[Br])=O)=S)c1nc2c(cccn2)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.5344 |
| logD: | 4.5193 |
| logSw: | -4.2841 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.726 |
| InChI Key: | YEFBTYXNCMDYRL-UHFFFAOYSA-N |