N-[(4-chlorophenyl)methyl]-2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
N-[(4-chlorophenyl)methyl]-2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide
Compound characteristics
| Compound ID: | K783-5724 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetamide |
| Molecular Weight: | 388.91 |
| Molecular Formula: | C20 H21 Cl N2 O2 S |
| Smiles: | CC1(C)CC(N(CC(NCc2ccc(cc2)[Cl])=O)c2ccccc2S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.464 |
| logD: | 4.464 |
| logSw: | -4.5985 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.421 |
| InChI Key: | CXVUVPZZACPYQP-UHFFFAOYSA-N |