4-(2,3-dimethylphenyl)-N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(2,3-dimethylphenyl)-N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)piperazine-1-carboxamide
4-(2,3-dimethylphenyl)-N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | E006-0019 |
| Compound Name: | 4-(2,3-dimethylphenyl)-N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)piperazine-1-carboxamide |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C27 H28 N4 O2 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(Nc1ccc2c(c1)N(C)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4818 |
| logD: | 5.4806 |
| logSw: | -5.4046 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.866 |
| InChI Key: | GNHKJPFJTJQZPN-UHFFFAOYSA-N |