N-[3-(azepan-1-yl)butyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)butyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[3-(azepan-1-yl)butyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
Compound ID: | L914-0739 |
Compound Name: | N-[3-(azepan-1-yl)butyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
Molecular Weight: | 427.5 |
Molecular Formula: | C22 H29 N5 O4 |
Smiles: | CC(CCNC(c1nc(CN2C(=O)Oc3ccc(C)cc23)no1)=O)N1CCCCCC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6263 |
logD: | -0.3061 |
logSw: | -3.0585 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.233 |
InChI Key: | YKVDQJDQWZOQPE-INIZCTEOSA-N |