4-({5-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-({5-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
4-({5-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F621-0085 |
| Compound Name: | 4-({5-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-3-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 355.78 |
| Molecular Formula: | C18 H14 Cl N3 O3 |
| Smiles: | C(c1ccc(cc1)[Cl])c1nc(CN2C(COc3ccccc23)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.2395 |
| logD: | 3.2395 |
| logSw: | -3.5219 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.402 |
| InChI Key: | WQMPQKVPNYGXOA-UHFFFAOYSA-N |