9-[(4-bromophenyl)methoxy]-3-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
9-[(4-bromophenyl)methoxy]-3-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
9-[(4-bromophenyl)methoxy]-3-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | V008-0901 |
| Compound Name: | 9-[(4-bromophenyl)methoxy]-3-[1-(5-chloro-2-methylphenyl)-5-methyl-1H-pyrazol-3-yl]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 549.85 |
| Molecular Formula: | C27 H22 Br Cl N4 O2 |
| Smiles: | CC1=C(C(N2C=CC=C(C2=N1)OCc1ccc(cc1)[Br])=O)c1cc(C)n(c2cc(ccc2C)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0419 |
| logD: | 6.0387 |
| logSw: | -6.0863 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.568 |
| InChI Key: | LJMLTRLGRGHDNQ-UHFFFAOYSA-N |