2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)-N-[(4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)-N-[(4-fluorophenyl)methyl]acetamide
2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)-N-[(4-fluorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K783-5765 |
| Compound Name: | 2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)-N-[(4-fluorophenyl)methyl]acetamide |
| Molecular Weight: | 372.46 |
| Molecular Formula: | C20 H21 F N2 O2 S |
| Smiles: | CC1(C)CC(N(CC(NCc2ccc(cc2)F)=O)c2ccccc2S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8984 |
| logD: | 3.8984 |
| logSw: | -3.9734 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.421 |
| InChI Key: | ZAMWUYXWCBKVRZ-UHFFFAOYSA-N |