5-[(4-fluorophenyl)methyl]-2-[(2-methylphenyl)methyl]-2,3-dihydro-1H-1lambda~6~,2,5-benzothiadiazepine-1,1,4(5H)-trione
Chemical Structure Depiction of
5-[(4-fluorophenyl)methyl]-2-[(2-methylphenyl)methyl]-2,3-dihydro-1H-1lambda~6~,2,5-benzothiadiazepine-1,1,4(5H)-trione
5-[(4-fluorophenyl)methyl]-2-[(2-methylphenyl)methyl]-2,3-dihydro-1H-1lambda~6~,2,5-benzothiadiazepine-1,1,4(5H)-trione
Compound characteristics
| Compound ID: | L051-0002 |
| Compound Name: | 5-[(4-fluorophenyl)methyl]-2-[(2-methylphenyl)methyl]-2,3-dihydro-1H-1lambda~6~,2,5-benzothiadiazepine-1,1,4(5H)-trione |
| Molecular Weight: | 424.49 |
| Molecular Formula: | C23 H21 F N2 O3 S |
| Smiles: | Cc1ccccc1CN1CC(N(Cc2ccc(cc2)F)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4664 |
| logD: | 4.4664 |
| logSw: | -4.2595 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.273 |
| InChI Key: | MBPCTJPTRDQTLU-UHFFFAOYSA-N |