6-{5-[(3,5-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{5-[(3,5-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
6-{5-[(3,5-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
Compound ID: | M355-0888 |
Compound Name: | 6-{5-[(3,5-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one |
Molecular Weight: | 395.41 |
Molecular Formula: | C21 H21 N3 O5 |
Smiles: | CC(C)N1C(=O)Oc2cc(ccc12)c1nc(Cc2cc(cc(c2)OC)OC)on1 |
Stereo: | ACHIRAL |
logP: | 4.539 |
logD: | 4.539 |
logSw: | -4.5414 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 69.218 |
InChI Key: | AYZGCHPLEBRYAV-UHFFFAOYSA-N |