methyl phenyl{[2-(pyridin-4-yl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carbonyl]amino}acetate
Chemical Structure Depiction of
methyl phenyl{[2-(pyridin-4-yl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carbonyl]amino}acetate
methyl phenyl{[2-(pyridin-4-yl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carbonyl]amino}acetate
Compound characteristics
| Compound ID: | P221-0817 |
| Compound Name: | methyl phenyl{[2-(pyridin-4-yl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carbonyl]amino}acetate |
| Molecular Weight: | 405.46 |
| Molecular Formula: | C22 H23 N5 O3 |
| Smiles: | COC(C(c1ccccc1)NC(N1CCCn2c(C1)cc(c1ccncc1)n2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9874 |
| logD: | 1.9865 |
| logSw: | -2.3398 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.514 |
| InChI Key: | YZVBVMMYUDMMEW-HXUWFJFHSA-N |