N-(2-methoxyphenyl)-3-(3-{[(5-methyl-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(2-methoxyphenyl)-3-(3-{[(5-methyl-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(2-methoxyphenyl)-3-(3-{[(5-methyl-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
Compound ID: | J021-0173 |
Compound Name: | N-(2-methoxyphenyl)-3-(3-{[(5-methyl-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
Molecular Weight: | 424.48 |
Molecular Formula: | C21 H20 N4 O4 S |
Smiles: | Cc1ccc2c(c1)nc(o2)SCc1nc(CCC(Nc2ccccc2OC)=O)on1 |
Stereo: | ACHIRAL |
logP: | 3.8655 |
logD: | 3.8654 |
logSw: | -3.9354 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.046 |
InChI Key: | AVGMJUPCLMNTPD-UHFFFAOYSA-N |