2,4-dichloro-N-(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
2,4-dichloro-N-(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2-yl)benzamide
2,4-dichloro-N-(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
Compound ID: | 3202-0029 |
Compound Name: | 2,4-dichloro-N-(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2-yl)benzamide |
Molecular Weight: | 436.36 |
Molecular Formula: | C20 H19 Cl2 N3 O2 S |
Smiles: | CC(C)c1ccc(C)cc1OCc1nnc(NC(c2ccc(cc2[Cl])[Cl])=O)s1 |
Stereo: | ACHIRAL |
logP: | 6.5046 |
logD: | 3.6862 |
logSw: | -6.2333 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.684 |
InChI Key: | KULRLDIJQQLLPJ-UHFFFAOYSA-N |