2-[11-oxo-8-(pyrrolidine-1-carbonyl)dibenzo[b,f][1,4]thiazepin-10(11H)-yl]-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-[11-oxo-8-(pyrrolidine-1-carbonyl)dibenzo[b,f][1,4]thiazepin-10(11H)-yl]-N-(2-phenylethyl)acetamide
2-[11-oxo-8-(pyrrolidine-1-carbonyl)dibenzo[b,f][1,4]thiazepin-10(11H)-yl]-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | K788-3896 |
| Compound Name: | 2-[11-oxo-8-(pyrrolidine-1-carbonyl)dibenzo[b,f][1,4]thiazepin-10(11H)-yl]-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C28 H27 N3 O3 S |
| Smiles: | C1CCN(C1)C(c1ccc2c(c1)N(CC(NCCc1ccccc1)=O)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6464 |
| logD: | 3.6464 |
| logSw: | -4.0089 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.728 |
| InChI Key: | MIDFIGUJEQUTMG-UHFFFAOYSA-N |