11-chloro-3-[2-(4-fluorophenyl)ethyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Chemical Structure Depiction of
11-chloro-3-[2-(4-fluorophenyl)ethyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
11-chloro-3-[2-(4-fluorophenyl)ethyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one
Compound characteristics
| Compound ID: | D144-0361 |
| Compound Name: | 11-chloro-3-[2-(4-fluorophenyl)ethyl]-3,4,8,9-tetrahydro-2H-cyclopenta[4,5]pyrano[2,3-f][1,3]benzoxazin-6(7H)-one |
| Molecular Weight: | 399.85 |
| Molecular Formula: | C22 H19 Cl F N O3 |
| Smiles: | C1CC2=C(C1)c1cc(c3c(CN(CCc4ccc(cc4)F)CO3)c1OC2=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9248 |
| logD: | 4.7734 |
| logSw: | -5.0364 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.378 |
| InChI Key: | GCXDWXCOUNDXJB-UHFFFAOYSA-N |