N-{[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-{[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}-3-phenylprop-2-enamide
N-{[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | 3901-0115 |
| Compound Name: | N-{[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}-3-phenylprop-2-enamide |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C23 H18 N4 O2 S |
| Smiles: | Cc1c(cccc1NC(NC(/C=C/c1ccccc1)=O)=S)c1nc2c(cccn2)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.8445 |
| logD: | 4.8444 |
| logSw: | -4.5127 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.513 |
| InChI Key: | UYJPERHAOBGJEO-UHFFFAOYSA-N |