6-[(4-bromophenyl)methyl]-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
6-[(4-bromophenyl)methyl]-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
6-[(4-bromophenyl)methyl]-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | 8563-0501 |
| Compound Name: | 6-[(4-bromophenyl)methyl]-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 408.3 |
| Molecular Formula: | C21 H18 Br N3 O |
| Smiles: | CC1=C(Cc2ccc(cc2)[Br])C(n2c(c(c3ccccc3)c(C)n2)N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6075 |
| logD: | 4.6008 |
| logSw: | -4.5558 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.448 |
| InChI Key: | QHOYIGQICBVDDF-UHFFFAOYSA-N |