butyl 4-[2-(4-methylpiperidine-1-carbonyl)-1,1-dioxo-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
Chemical Structure Depiction of
butyl 4-[2-(4-methylpiperidine-1-carbonyl)-1,1-dioxo-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
butyl 4-[2-(4-methylpiperidine-1-carbonyl)-1,1-dioxo-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
Compound characteristics
Compound ID: | L810-0149 |
Compound Name: | butyl 4-[2-(4-methylpiperidine-1-carbonyl)-1,1-dioxo-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate |
Molecular Weight: | 482.6 |
Molecular Formula: | C26 H30 N2 O5 S |
Smiles: | CCCCOC(c1ccc(cc1)N1C=C(C(N2CCC(C)CC2)=O)S(c2ccccc12)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.335 |
logD: | 4.335 |
logSw: | -4.1377 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 68.647 |
InChI Key: | JICGUMGWKGAXKZ-UHFFFAOYSA-N |