4-[2-(1-methyl-1H-pyrrol-2-yl)-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]-4-oxo-N-[(4-propoxyphenyl)methyl]butanamide
Chemical Structure Depiction of
4-[2-(1-methyl-1H-pyrrol-2-yl)-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]-4-oxo-N-[(4-propoxyphenyl)methyl]butanamide
4-[2-(1-methyl-1H-pyrrol-2-yl)-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]-4-oxo-N-[(4-propoxyphenyl)methyl]butanamide
Compound characteristics
Compound ID: | E989-0895 |
Compound Name: | 4-[2-(1-methyl-1H-pyrrol-2-yl)-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]-4-oxo-N-[(4-propoxyphenyl)methyl]butanamide |
Molecular Weight: | 449.55 |
Molecular Formula: | C25 H31 N5 O3 |
Smiles: | CCCOc1ccc(CNC(CCC(N2CCCn3c2cc(c2cccn2C)n3)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.6796 |
logD: | 3.6796 |
logSw: | -3.7116 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.732 |
InChI Key: | UZYKRRZRFNKFMZ-UHFFFAOYSA-N |