(1S)-1-(5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)-3-methylbutan-1-amine
Chemical Structure Depiction of
(1S)-1-(5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)-3-methylbutan-1-amine
(1S)-1-(5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)-3-methylbutan-1-amine
Compound characteristics
Compound ID: | 8388-0696 |
Compound Name: | (1S)-1-(5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)-3-methylbutan-1-amine |
Molecular Weight: | 346.28 |
Molecular Formula: | C14 H17 Cl2 N3 O S |
Smiles: | CC(C)C[C@@H](c1nnc(o1)SCc1c(cccc1[Cl])[Cl])N |
Stereo: | RACEMIC MIXTURE |
logP: | 2.908 |
logD: | 2.535 |
logSw: | -3.4288 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.124 |
InChI Key: | HQXSJBGYQWMNLG-LBPRGKRZSA-N |