2-(4-nitrophenyl)-4-(thiophen-2-yl)-2,3-dihydro-1,5-benzothiazepine
Chemical Structure Depiction of
2-(4-nitrophenyl)-4-(thiophen-2-yl)-2,3-dihydro-1,5-benzothiazepine
2-(4-nitrophenyl)-4-(thiophen-2-yl)-2,3-dihydro-1,5-benzothiazepine
Compound characteristics
| Compound ID: | 3333-3218 |
| Compound Name: | 2-(4-nitrophenyl)-4-(thiophen-2-yl)-2,3-dihydro-1,5-benzothiazepine |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C19 H14 N2 O2 S2 |
| Smiles: | C1C(c2ccc(cc2)[N+]([O-])=O)Sc2ccccc2N=C1c1cccs1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2689 |
| logD: | 5.2688 |
| logSw: | -5.537 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.258 |
| InChI Key: | YVWVQUJEUDRKOA-IBGZPJMESA-N |