6-methyl-9-(2-phenylethyl)-2,3,9,10-tetrahydro-8H-cyclopenta[4,5]pyrano[3,2-g][1,3]benzoxazin-4(1H)-one
Chemical Structure Depiction of
6-methyl-9-(2-phenylethyl)-2,3,9,10-tetrahydro-8H-cyclopenta[4,5]pyrano[3,2-g][1,3]benzoxazin-4(1H)-one
6-methyl-9-(2-phenylethyl)-2,3,9,10-tetrahydro-8H-cyclopenta[4,5]pyrano[3,2-g][1,3]benzoxazin-4(1H)-one
Compound characteristics
| Compound ID: | D144-0681 |
| Compound Name: | 6-methyl-9-(2-phenylethyl)-2,3,9,10-tetrahydro-8H-cyclopenta[4,5]pyrano[3,2-g][1,3]benzoxazin-4(1H)-one |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C23 H23 N O3 |
| Smiles: | Cc1c2c(CN(CCc3ccccc3)CO2)cc2C3CCCC=3C(=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.4469 |
| logD: | 3.3315 |
| logSw: | -4.3651 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.378 |
| InChI Key: | DNJFGNCTFBJZEH-UHFFFAOYSA-N |