methyl 3-({6-[(4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}methyl)-4-methoxybenzoate
Chemical Structure Depiction of
methyl 3-({6-[(4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}methyl)-4-methoxybenzoate
methyl 3-({6-[(4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}methyl)-4-methoxybenzoate
Compound characteristics
| Compound ID: | E871-0130 |
| Compound Name: | methyl 3-({6-[(4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}methyl)-4-methoxybenzoate |
| Molecular Weight: | 422.47 |
| Molecular Formula: | C20 H23 F N2 O5 S |
| Smiles: | COC(c1ccc(c(CN2CCCN(Cc3ccc(cc3)F)S2(=O)=O)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0475 |
| logD: | 3.0475 |
| logSw: | -3.2695 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.183 |
| InChI Key: | YCJZNDLVRIGESP-UHFFFAOYSA-N |