1-[7-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[7-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
1-[7-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | G269-0938 |
| Compound Name: | 1-[7-(2,3-dihydro-1H-indole-1-sulfonyl)-2-methyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]ethan-1-one |
| Molecular Weight: | 402.53 |
| Molecular Formula: | C20 H22 N2 O3 S2 |
| Smiles: | CC1CCN(C(C)=O)c2cc(ccc2S1)S(N1CCc2ccccc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5769 |
| logD: | 3.5769 |
| logSw: | -3.9096 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.14 |
| InChI Key: | ILHPTGBKPYSFAX-CQSZACIVSA-N |