6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-8-chloro-2-methyl-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinolin-7-one
Chemical Structure Depiction of
6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-8-chloro-2-methyl-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinolin-7-one
6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-8-chloro-2-methyl-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinolin-7-one
Compound characteristics
| Compound ID: | E631-0031 |
| Compound Name: | 6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-8-chloro-2-methyl-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinolin-7-one |
| Molecular Weight: | 481.94 |
| Molecular Formula: | C25 H24 Cl N3 O5 |
| Smiles: | CC1CN2C=C(C(c3c(ccc(c23)O1)[Cl])=O)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6131 |
| logD: | 2.3708 |
| logSw: | -3.493 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.235 |
| InChI Key: | WSCXYQXHTOWCJS-OAHLLOKOSA-N |