N-[(furan-2-yl)methyl]-2-[2-methyl-4-oxo-7-(piperidine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-2-[2-methyl-4-oxo-7-(piperidine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-[(furan-2-yl)methyl]-2-[2-methyl-4-oxo-7-(piperidine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G640-1013 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-[2-methyl-4-oxo-7-(piperidine-1-sulfonyl)-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C22 H27 N3 O5 S2 |
| Smiles: | CC1CC(N(CC(NCc2ccco2)=O)c2cc(ccc2S1)S(N1CCCCC1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2178 |
| logD: | 3.2178 |
| logSw: | -3.6922 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.881 |
| InChI Key: | ANAQPOAUZKENRN-MRXNPFEDSA-N |