10-[(3-fluorophenyl)methyl]-N-(3-methoxypropyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(3-fluorophenyl)methyl]-N-(3-methoxypropyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(3-fluorophenyl)methyl]-N-(3-methoxypropyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-4582 |
| Compound Name: | 10-[(3-fluorophenyl)methyl]-N-(3-methoxypropyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 450.53 |
| Molecular Formula: | C25 H23 F N2 O3 S |
| Smiles: | COCCCNC(c1ccc2c(c1)N(Cc1cccc(c1)F)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6587 |
| logD: | 4.6587 |
| logSw: | -4.4215 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.269 |
| InChI Key: | PBUHXRBZYWGIDZ-UHFFFAOYSA-N |