N-[(furan-2-yl)methyl]-2-[7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-2-[7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-[(furan-2-yl)methyl]-2-[7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G640-0299 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-[7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C22 H27 N3 O5 S2 |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)N(CC(NCc1ccco1)=O)C(CCS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.46 |
| logD: | 3.46 |
| logSw: | -3.9846 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.881 |
| InChI Key: | MHJKIERVFWZUCQ-UHFFFAOYSA-N |