3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-5-methyl-5H-pyridazino[3,4-b][1,4]benzoxazine
Chemical Structure Depiction of
3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-5-methyl-5H-pyridazino[3,4-b][1,4]benzoxazine
3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-5-methyl-5H-pyridazino[3,4-b][1,4]benzoxazine
Compound characteristics
| Compound ID: | C301-4053 |
| Compound Name: | 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-5-methyl-5H-pyridazino[3,4-b][1,4]benzoxazine |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C23 H25 N5 O |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)c1cc2c(nn1)Oc1ccccc1N2C |
| Stereo: | ACHIRAL |
| logP: | 4.8979 |
| logD: | 3.6586 |
| logSw: | -4.6743 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 37.025 |
| InChI Key: | MJCHQXHFIZHFGY-UHFFFAOYSA-N |