methyl 5-{[4,4-dioxo-3-(piperidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazin-1(4H)-yl]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[4,4-dioxo-3-(piperidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazin-1(4H)-yl]methyl}furan-2-carboxylate
methyl 5-{[4,4-dioxo-3-(piperidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazin-1(4H)-yl]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | M786-3012 |
| Compound Name: | methyl 5-{[4,4-dioxo-3-(piperidine-1-carbonyl)-4lambda~6~,1,2-benzothiadiazin-1(4H)-yl]methyl}furan-2-carboxylate |
| Molecular Weight: | 431.47 |
| Molecular Formula: | C20 H21 N3 O6 S |
| Smiles: | COC(c1ccc(CN2c3ccccc3S(C(C(N3CCCCC3)=O)=N2)(=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9659 |
| logD: | 1.9659 |
| logSw: | -2.3945 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.353 |
| InChI Key: | JLEWLYWVOPPQBM-UHFFFAOYSA-N |