7-[(1,3-benzothiazol-2-yl)amino]-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
7-[(1,3-benzothiazol-2-yl)amino]-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
7-[(1,3-benzothiazol-2-yl)amino]-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | Y020-8746 |
| Compound Name: | 7-[(1,3-benzothiazol-2-yl)amino]-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 411.44 |
| Molecular Formula: | C21 H13 N7 O S |
| Smiles: | C1=CN(C(C2C=Nc3nc(c4ccccc4)nn3C1=2)=O)Nc1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.921 |
| logD: | 3.9206 |
| logSw: | -4.1627 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.981 |
| InChI Key: | PGHXXGNRMZSBIX-UHFFFAOYSA-N |