methyl 2-acetamido-6-bromo-7-{[1-(morpholin-4-yl)-1-oxobutan-2-yl]oxy}-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-acetamido-6-bromo-7-{[1-(morpholin-4-yl)-1-oxobutan-2-yl]oxy}-1-benzothiophene-3-carboxylate
methyl 2-acetamido-6-bromo-7-{[1-(morpholin-4-yl)-1-oxobutan-2-yl]oxy}-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | L068-0667 |
| Compound Name: | methyl 2-acetamido-6-bromo-7-{[1-(morpholin-4-yl)-1-oxobutan-2-yl]oxy}-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 499.38 |
| Molecular Formula: | C20 H23 Br N2 O6 S |
| Smiles: | CCC(C(N1CCOCC1)=O)Oc1c(ccc2c(C(=O)OC)c(NC(C)=O)sc12)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.937 |
| logD: | 2.9265 |
| logSw: | -3.3494 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.599 |
| InChI Key: | JMYWFJITDKOOIN-AWEZNQCLSA-N |