methyl 10-[(4-ethoxyphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
methyl 10-[(4-ethoxyphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
methyl 10-[(4-ethoxyphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | K783-6876 |
| Compound Name: | methyl 10-[(4-ethoxyphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C24 H21 N O4 S |
| Smiles: | CCOc1ccc(CN2C(c3ccccc3Sc3ccc(cc23)C(=O)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6868 |
| logD: | 5.6868 |
| logSw: | -5.4117 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.698 |
| InChI Key: | JFVBIZGUAQQJHY-UHFFFAOYSA-N |