N-[2-(azepan-1-yl)ethyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[2-(azepan-1-yl)ethyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
Compound ID: | L914-0646 |
Compound Name: | N-[2-(azepan-1-yl)ethyl]-3-[(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
Molecular Weight: | 399.45 |
Molecular Formula: | C20 H25 N5 O4 |
Smiles: | Cc1ccc2c(c1)N(Cc1nc(C(NCCN3CCCCCC3)=O)on1)C(=O)O2 |
Stereo: | ACHIRAL |
logP: | 2.289 |
logD: | 0.691 |
logSw: | -2.9504 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.575 |
InChI Key: | LXYVGKHEQZAGJW-UHFFFAOYSA-N |