6-chloro-4-({3-[3-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-({3-[3-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-({3-[3-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F545-2499 |
| Compound Name: | 6-chloro-4-({3-[3-(morpholine-4-carbonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 454.87 |
| Molecular Formula: | C22 H19 Cl N4 O5 |
| Smiles: | C1COCCN1C(c1cccc(c1)c1nc(CN2C(COc3ccc(cc23)[Cl])=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3873 |
| logD: | 2.3873 |
| logSw: | -3.1583 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.968 |
| InChI Key: | CTWDTGHWNUIISV-UHFFFAOYSA-N |