3-[(4-methylanilino)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
Chemical Structure Depiction of
3-[(4-methylanilino)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
3-[(4-methylanilino)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione
Compound characteristics
Compound ID: | 8009-5503 |
Compound Name: | 3-[(4-methylanilino)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole-2(3H)-thione |
Molecular Weight: | 387.46 |
Molecular Formula: | C19 H21 N3 O4 S |
Smiles: | Cc1ccc(cc1)NCN1C(OC(c2cc(c(c(c2)OC)OC)OC)=N1)=S |
Stereo: | ACHIRAL |
logP: | 3.8272 |
logD: | 3.8272 |
logSw: | -4.0753 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.326 |
InChI Key: | LZCFOUURNUCRRL-UHFFFAOYSA-N |