9-[(furan-2-yl)methyl]-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
9-[(furan-2-yl)methyl]-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
9-[(furan-2-yl)methyl]-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | Y040-1620 |
| Compound Name: | 9-[(furan-2-yl)methyl]-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 311.34 |
| Molecular Formula: | C18 H17 N O4 |
| Smiles: | CC1=C(C)c2ccc3c(CN(Cc4ccco4)CO3)c2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 3.3887 |
| logD: | 3.3273 |
| logSw: | -3.7381 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.178 |
| InChI Key: | NPTQMCDIHUUWRD-UHFFFAOYSA-N |