N-(4-ethoxyphenyl)-2-{6-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-{6-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamide
N-(4-ethoxyphenyl)-2-{6-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamide
Compound characteristics
Compound ID: | C200-3500 |
Compound Name: | N-(4-ethoxyphenyl)-2-{6-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}acetamide |
Molecular Weight: | 417.53 |
Molecular Formula: | C21 H27 N3 O4 S |
Smiles: | CCOc1ccc(cc1)NC(CN1CCCN(Cc2ccc(C)cc2)S1(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.231 |
logD: | 3.231 |
logSw: | -3.4044 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.652 |
InChI Key: | FHTBLJKCKUSBAA-UHFFFAOYSA-N |