(furan-2-yl)methyl 10-[(4-cyanophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
(furan-2-yl)methyl 10-[(4-cyanophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
(furan-2-yl)methyl 10-[(4-cyanophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0525 |
| Compound Name: | (furan-2-yl)methyl 10-[(4-cyanophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 466.51 |
| Molecular Formula: | C27 H18 N2 O4 S |
| Smiles: | C(c1ccc(C#N)cc1)N1C(c2ccccc2Sc2ccc(cc12)C(=O)OCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8804 |
| logD: | 5.8804 |
| logSw: | -5.9851 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.063 |
| InChI Key: | AYGJTPMVBHSMBI-UHFFFAOYSA-N |