N-(4-ethoxyphenyl)-2-[3-methyl-7-(morpholine-4-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-[3-methyl-7-(morpholine-4-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-(4-ethoxyphenyl)-2-[3-methyl-7-(morpholine-4-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G640-0820 |
| Compound Name: | N-(4-ethoxyphenyl)-2-[3-methyl-7-(morpholine-4-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 519.64 |
| Molecular Formula: | C24 H29 N3 O6 S2 |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(C(C)CSc2ccc(cc12)S(N1CCOCC1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2884 |
| logD: | 3.2884 |
| logSw: | -3.8406 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.565 |
| InChI Key: | XBKMPKBUDOSTBH-QGZVFWFLSA-N |