10-[(3-chlorophenyl)methyl]-5,5,11-trioxo-N-[(oxolan-2-yl)methyl]-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(3-chlorophenyl)methyl]-5,5,11-trioxo-N-[(oxolan-2-yl)methyl]-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(3-chlorophenyl)methyl]-5,5,11-trioxo-N-[(oxolan-2-yl)methyl]-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-8612 |
| Compound Name: | 10-[(3-chlorophenyl)methyl]-5,5,11-trioxo-N-[(oxolan-2-yl)methyl]-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 511 |
| Molecular Formula: | C26 H23 Cl N2 O5 S |
| Smiles: | C1CC(CNC(c2ccc3c(c2)N(Cc2cccc(c2)[Cl])C(c2ccccc2S3(=O)=O)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4408 |
| logD: | 3.4408 |
| logSw: | -4.051 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.449 |
| InChI Key: | SDOJYFUKPUYGTL-HXUWFJFHSA-N |