ethyl 4-[2-methyl-3-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-methyl-3-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamido]benzoate
ethyl 4-[2-methyl-3-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamido]benzoate
Compound characteristics
| Compound ID: | E912-0505 |
| Compound Name: | ethyl 4-[2-methyl-3-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamido]benzoate |
| Molecular Weight: | 476.57 |
| Molecular Formula: | C22 H24 N2 O6 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(C(C)CS(c1ccc2c(c1)NC(C(C)S2)=O)(=O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1051 |
| logD: | 3.1034 |
| logSw: | -3.4784 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.997 |
| InChI Key: | PGAJXMYXEJHRBG-UHFFFAOYSA-N |