3-[2-(4-chlorophenyl)ethyl]-6-ethyl-10-methyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Chemical Structure Depiction of
3-[2-(4-chlorophenyl)ethyl]-6-ethyl-10-methyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
3-[2-(4-chlorophenyl)ethyl]-6-ethyl-10-methyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Compound characteristics
| Compound ID: | D144-0715 |
| Compound Name: | 3-[2-(4-chlorophenyl)ethyl]-6-ethyl-10-methyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one |
| Molecular Weight: | 383.87 |
| Molecular Formula: | C22 H22 Cl N O3 |
| Smiles: | CCC1=CC(=O)Oc2c1cc1CN(CCc3ccc(cc3)[Cl])COc1c2C |
| Stereo: | ACHIRAL |
| logP: | 5.1112 |
| logD: | 3.9958 |
| logSw: | -5.2574 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.577 |
| InChI Key: | WQSYBHYGVJNMSJ-UHFFFAOYSA-N |