10-[(3-methylphenyl)methyl]-11-oxo-N-[(thiophen-2-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(3-methylphenyl)methyl]-11-oxo-N-[(thiophen-2-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(3-methylphenyl)methyl]-11-oxo-N-[(thiophen-2-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K784-7793 |
| Compound Name: | 10-[(3-methylphenyl)methyl]-11-oxo-N-[(thiophen-2-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 470.61 |
| Molecular Formula: | C27 H22 N2 O2 S2 |
| Smiles: | Cc1cccc(CN2C(c3ccccc3Sc3ccc(cc23)C(NCc2cccs2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.4659 |
| logD: | 6.4659 |
| logSw: | -5.6014 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.832 |
| InChI Key: | BUJIPWVASJYAKD-UHFFFAOYSA-N |