N-(2-ethyl-6-methylphenyl)-2-[2-methyl-4-oxo-7-(piperidine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-2-[2-methyl-4-oxo-7-(piperidine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-(2-ethyl-6-methylphenyl)-2-[2-methyl-4-oxo-7-(piperidine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G640-1046 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-2-[2-methyl-4-oxo-7-(piperidine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 515.69 |
| Molecular Formula: | C26 H33 N3 O4 S2 |
| Smiles: | CCc1cccc(C)c1NC(CN1C(CC(C)Sc2ccc(cc12)S(N1CCCCC1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5581 |
| logD: | 4.5581 |
| logSw: | -4.2208 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.415 |
| InChI Key: | CHHAZGGFRLHBII-LJQANCHMSA-N |