4-(2-{4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-(2-{4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-methyl-2H-1,4-benzoxazin-3(4H)-one
4-(2-{4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F980-0447 |
| Compound Name: | 4-(2-{4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 487.56 |
| Molecular Formula: | C27 H29 N5 O4 |
| Smiles: | CC1C(N(CC(N2CCN(CC2)C2C=CC(N(c3ccc(C)c(C)c3)N=2)=O)=O)c2ccccc2O1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8747 |
| logD: | 2.8747 |
| logSw: | -3.2368 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.739 |
| InChI Key: | JYGPVGPGIAWUNC-HXUWFJFHSA-N |