10-[(2-fluorophenyl)methyl]-11-oxo-N-[(pyridin-3-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(2-fluorophenyl)methyl]-11-oxo-N-[(pyridin-3-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(2-fluorophenyl)methyl]-11-oxo-N-[(pyridin-3-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-3239 |
| Compound Name: | 10-[(2-fluorophenyl)methyl]-11-oxo-N-[(pyridin-3-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 469.54 |
| Molecular Formula: | C27 H20 F N3 O2 S |
| Smiles: | C(c1cccnc1)NC(c1ccc2c(c1)N(Cc1ccccc1F)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7569 |
| logD: | 4.7568 |
| logSw: | -4.6647 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.332 |
| InChI Key: | CEKFVCGSCSEOEX-UHFFFAOYSA-N |