(3-cyanophenyl)methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Chemical Structure Depiction of
(3-cyanophenyl)methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
(3-cyanophenyl)methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Compound characteristics
| Compound ID: | T744-0135 |
| Compound Name: | (3-cyanophenyl)methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate |
| Molecular Weight: | 319.34 |
| Molecular Formula: | C14 H13 N3 O4 S |
| Smiles: | CC1C(=CN(C)S(N=1)(=O)=O)C(=O)OCc1cccc(C#N)c1 |
| Stereo: | ACHIRAL |
| logP: | 0.6571 |
| logD: | 0.6571 |
| logSw: | -2.0666 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.639 |
| InChI Key: | KSCKSLSARAXOPC-UHFFFAOYSA-N |