4-{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}-1-[(4-methylphenyl)methyl]pyrrolidin-2-one
Chemical Structure Depiction of
4-{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}-1-[(4-methylphenyl)methyl]pyrrolidin-2-one
4-{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}-1-[(4-methylphenyl)methyl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | S565-1494 |
| Compound Name: | 4-{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl}-1-[(4-methylphenyl)methyl]pyrrolidin-2-one |
| Molecular Weight: | 473.58 |
| Molecular Formula: | C26 H31 N7 O2 |
| Smiles: | Cc1ccc(CN2CC(CC2=O)C(N2CCc3c(C2)c(c2nncn2CC2CC2)nn3C)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9236 |
| logD: | 0.9224 |
| logSw: | -1.7223 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.37 |
| InChI Key: | BGCSSQOQTYNWGE-HXUWFJFHSA-N |