2-methyl-1-[2-(morpholin-4-yl)-8-nitro-2H-1-benzopyran-3-yl]propan-1-one
Chemical Structure Depiction of
2-methyl-1-[2-(morpholin-4-yl)-8-nitro-2H-1-benzopyran-3-yl]propan-1-one
2-methyl-1-[2-(morpholin-4-yl)-8-nitro-2H-1-benzopyran-3-yl]propan-1-one
Compound characteristics
| Compound ID: | 8009-8643 |
| Compound Name: | 2-methyl-1-[2-(morpholin-4-yl)-8-nitro-2H-1-benzopyran-3-yl]propan-1-one |
| Molecular Weight: | 332.35 |
| Molecular Formula: | C17 H20 N2 O5 |
| Smiles: | CC(C)C(C1=Cc2cccc(c2OC1N1CCOCC1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7762 |
| logD: | 2.7761 |
| logSw: | -3.2043 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.263 |
| InChI Key: | PNCNOXNHJPZNTE-KRWDZBQOSA-N |