7-([1,4'-bipiperidine]-1'-sulfonyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Chemical Structure Depiction of
7-([1,4'-bipiperidine]-1'-sulfonyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
7-([1,4'-bipiperidine]-1'-sulfonyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Compound characteristics
| Compound ID: | E975-1576 |
| Compound Name: | 7-([1,4'-bipiperidine]-1'-sulfonyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one |
| Molecular Weight: | 409.57 |
| Molecular Formula: | C19 H27 N3 O3 S2 |
| Smiles: | C1CCN(CC1)C1CCN(CC1)S(c1ccc2c(c1)NC(CCS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.376 |
| logD: | 0.1169 |
| logSw: | -2.9423 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.195 |
| InChI Key: | NDKIJMQRNCRUAI-UHFFFAOYSA-N |