methyl 10-[(2-chlorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
methyl 10-[(2-chlorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
methyl 10-[(2-chlorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0180 |
| Compound Name: | methyl 10-[(2-chlorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 409.89 |
| Molecular Formula: | C22 H16 Cl N O3 S |
| Smiles: | COC(c1ccc2c(c1)N(Cc1ccccc1[Cl])C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8017 |
| logD: | 5.8017 |
| logSw: | -5.7445 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.574 |
| InChI Key: | PBSGDJLXDIDZIZ-UHFFFAOYSA-N |