methyl 2-[(3-chlorophenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Chemical Structure Depiction of
methyl 2-[(3-chlorophenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
methyl 2-[(3-chlorophenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Compound characteristics
| Compound ID: | S342-1264 |
| Compound Name: | methyl 2-[(3-chlorophenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate |
| Molecular Weight: | 328.77 |
| Molecular Formula: | C13 H13 Cl N2 O4 S |
| Smiles: | CC1C(=CN(Cc2cccc(c2)[Cl])S(N=1)(=O)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.7442 |
| logD: | 1.7442 |
| logSw: | -2.7517 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.673 |
| InChI Key: | LQMXVQWBDOQFNH-UHFFFAOYSA-N |