3-benzyl-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Chemical Structure Depiction of
3-benzyl-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
3-benzyl-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Compound characteristics
| Compound ID: | C202-2010 |
| Compound Name: | 3-benzyl-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C21 H19 N O3 |
| Smiles: | C1CC2=C(C1)c1ccc3c(CN(Cc4ccccc4)CO3)c1OC2=O |
| Stereo: | ACHIRAL |
| logP: | 3.8025 |
| logD: | 3.6294 |
| logSw: | -4.1313 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.715 |
| InChI Key: | GLPIEQFNBFSMFW-UHFFFAOYSA-N |