3-benzoyl-1,1-dioxo-2-propyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (4-methylphenoxy)acetate
					Chemical Structure Depiction of
3-benzoyl-1,1-dioxo-2-propyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (4-methylphenoxy)acetate
			3-benzoyl-1,1-dioxo-2-propyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (4-methylphenoxy)acetate
Compound characteristics
| Compound ID: | D097-0037 | 
| Compound Name: | 3-benzoyl-1,1-dioxo-2-propyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (4-methylphenoxy)acetate | 
| Molecular Weight: | 491.56 | 
| Molecular Formula: | C27 H25 N O6 S | 
| Smiles: | CCCN1C(=C(c2ccccc2S1(=O)=O)OC(COc1ccc(C)cc1)=O)C(c1ccccc1)=O | 
| Stereo: | ACHIRAL | 
| logP: | 4.992 | 
| logD: | 4.992 | 
| logSw: | -4.6894 | 
| Hydrogen bond acceptors count: | 10 | 
| Polar surface area: | 72.989 | 
| InChI Key: | JQHTXDNSGZMEGI-UHFFFAOYSA-N | 
 
				 
				