N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | E856-0213 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzamide |
| Molecular Weight: | 469.34 |
| Molecular Formula: | C22 H21 Br N4 O3 |
| Smiles: | COc1ccc(cc1CNC(c1ccc(CN2C(CCn3c2ccn3)=O)cc1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.1728 |
| logD: | 3.1728 |
| logSw: | -3.3498 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.47 |
| InChI Key: | XYKOWBYTMNIGIT-UHFFFAOYSA-N |