N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-10-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-10-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-10-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K784-7403 |
| Compound Name: | N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-10-[(4-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 522.62 |
| Molecular Formula: | C31 H26 N2 O4 S |
| Smiles: | Cc1ccc(CN2C(c3ccccc3Sc3ccc(cc23)C(NCC2COc3ccccc3O2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1311 |
| logD: | 6.1311 |
| logSw: | -5.4726 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.493 |
| InChI Key: | WBJFLKIJKUWUEX-QHCPKHFHSA-N |