N-(1-benzylpiperidin-4-yl)-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-(1-benzylpiperidin-4-yl)-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
Compound ID: | G542-2498 |
Compound Name: | N-(1-benzylpiperidin-4-yl)-5-[(3-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
Molecular Weight: | 471.6 |
Molecular Formula: | C28 H33 N5 O2 |
Smiles: | Cc1cccc(CN2CCCn3c(cc(C(NC4CCN(CC4)Cc4ccccc4)=O)n3)C2=O)c1 |
Stereo: | ACHIRAL |
logP: | 3.3317 |
logD: | 1.8865 |
logSw: | -3.5535 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.061 |
InChI Key: | UMCIPVXCEODLLN-UHFFFAOYSA-N |