7-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]amino}-6-[(thiophen-2-yl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]amino}-6-[(thiophen-2-yl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]amino}-6-[(thiophen-2-yl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C612-1167 |
| Compound Name: | 7-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]amino}-6-[(thiophen-2-yl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C24 H17 N5 O2 S |
| Smiles: | C(c1cccs1)N1C(c2c(cccn2)C1=O)Nc1ccc2c(c1)nc(c1cccnc1)o2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.613 |
| logD: | 3.611 |
| logSw: | -3.7672 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.257 |
| InChI Key: | JHCPLPHOFLILSR-QFIPXVFZSA-N |