6-[(4-bromophenyl)methyl]-3-(4-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
6-[(4-bromophenyl)methyl]-3-(4-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one
6-[(4-bromophenyl)methyl]-3-(4-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
Compound ID: | Y020-2018 |
Compound Name: | 6-[(4-bromophenyl)methyl]-3-(4-methoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one |
Molecular Weight: | 438.32 |
Molecular Formula: | C22 H20 Br N3 O2 |
Smiles: | CC1=C(Cc2ccc(cc2)[Br])C(n2c(c(c3ccc(cc3)OC)c(C)n2)N1)=O |
Stereo: | ACHIRAL |
logP: | 4.695 |
logD: | 4.6883 |
logSw: | -4.6521 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.991 |
InChI Key: | ANEJQEDTCKDUCD-UHFFFAOYSA-N |