(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl 2-[(4-methoxyphenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Chemical Structure Depiction of
(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl 2-[(4-methoxyphenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl 2-[(4-methoxyphenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Compound characteristics
| Compound ID: | S342-0112 |
| Compound Name: | (5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl 2-[(4-methoxyphenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate |
| Molecular Weight: | 460.51 |
| Molecular Formula: | C21 H24 N4 O6 S |
| Smiles: | CC1C(=CN(Cc2ccc(cc2)OC)S(N=1)(=O)=O)C(=O)OCc1nc(C2CCCC2)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.6595 |
| logD: | 2.6595 |
| logSw: | -2.854 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 104.126 |
| InChI Key: | CIZUPWNIDOEYEM-UHFFFAOYSA-N |