1-(4-bromophenyl)-3-methyl-4-(5-methylthiophene-2-carbonyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(4-bromophenyl)-3-methyl-4-(5-methylthiophene-2-carbonyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(4-bromophenyl)-3-methyl-4-(5-methylthiophene-2-carbonyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1208 |
| Compound Name: | 1-(4-bromophenyl)-3-methyl-4-(5-methylthiophene-2-carbonyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 430.32 |
| Molecular Formula: | C19 H16 Br N3 O2 S |
| Smiles: | Cc1c2C(CC(Nc2n(c2ccc(cc2)[Br])n1)=O)C(c1ccc(C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0605 |
| logD: | 3.9901 |
| logSw: | -4.0998 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.848 |
| InChI Key: | BXHCKLXFZXQLTC-AWEZNQCLSA-N |