N-(2-ethyl-6-methylphenyl)-2-{6-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-2-{6-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamide
N-(2-ethyl-6-methylphenyl)-2-{6-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamide
Compound characteristics
Compound ID: | E871-0485 |
Compound Name: | N-(2-ethyl-6-methylphenyl)-2-{6-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamide |
Molecular Weight: | 415.55 |
Molecular Formula: | C22 H29 N3 O3 S |
Smiles: | CCc1cccc(C)c1NC(CN1CCCN(Cc2ccc(C)cc2)S1(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5307 |
logD: | 3.5307 |
logSw: | -3.4584 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.132 |
InChI Key: | ODBOQCGYVVTJRK-UHFFFAOYSA-N |