N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(4-chlorophenyl)methyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(4-chlorophenyl)methyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(4-chlorophenyl)methyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | V017-5346 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(4-chlorophenyl)methyl]-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxamide |
| Molecular Weight: | 438.87 |
| Molecular Formula: | C22 H19 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1cc2C(N(CCn2n1)Cc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7603 |
| logD: | 2.7603 |
| logSw: | -3.5763 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.579 |
| InChI Key: | MKFBNXDMWYIKCM-UHFFFAOYSA-N |