2-{[3-(2,5-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-{[3-(2,5-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-{[3-(2,5-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | D262-1103 |
| Compound Name: | 2-{[3-(2,5-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 358.4 |
| Molecular Formula: | C21 H18 N4 O2 |
| Smiles: | Cc1ccc(C)c(c1)C1C=CC(N(CC2=CC(N3C=CC=CC3=N2)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6014 |
| logD: | 2.6014 |
| logSw: | -2.8662 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.534 |
| InChI Key: | IWKIXBUYFRQZEQ-UHFFFAOYSA-N |