methyl 4-[6-chloro-1,1-dioxo-2-(piperidine-1-carbonyl)-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
Chemical Structure Depiction of
methyl 4-[6-chloro-1,1-dioxo-2-(piperidine-1-carbonyl)-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
methyl 4-[6-chloro-1,1-dioxo-2-(piperidine-1-carbonyl)-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate
Compound characteristics
| Compound ID: | L810-0697 |
| Compound Name: | methyl 4-[6-chloro-1,1-dioxo-2-(piperidine-1-carbonyl)-1lambda~6~,4-benzothiazin-4(1H)-yl]benzoate |
| Molecular Weight: | 460.94 |
| Molecular Formula: | C22 H21 Cl N2 O5 S |
| Smiles: | COC(c1ccc(cc1)N1C=C(C(N2CCCCC2)=O)S(c2ccc(cc12)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2509 |
| logD: | 3.2509 |
| logSw: | -3.7052 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.773 |
| InChI Key: | YONUEBRLRGUBFQ-UHFFFAOYSA-N |