5-[(4-chlorophenyl)methyl]-2-[(3-methylphenyl)methyl]-2,3-dihydro-1H-1lambda~6~,2,5-benzothiadiazepine-1,1,4(5H)-trione
Chemical Structure Depiction of
5-[(4-chlorophenyl)methyl]-2-[(3-methylphenyl)methyl]-2,3-dihydro-1H-1lambda~6~,2,5-benzothiadiazepine-1,1,4(5H)-trione
5-[(4-chlorophenyl)methyl]-2-[(3-methylphenyl)methyl]-2,3-dihydro-1H-1lambda~6~,2,5-benzothiadiazepine-1,1,4(5H)-trione
Compound characteristics
| Compound ID: | L051-0057 |
| Compound Name: | 5-[(4-chlorophenyl)methyl]-2-[(3-methylphenyl)methyl]-2,3-dihydro-1H-1lambda~6~,2,5-benzothiadiazepine-1,1,4(5H)-trione |
| Molecular Weight: | 440.95 |
| Molecular Formula: | C23 H21 Cl N2 O3 S |
| Smiles: | Cc1cccc(CN2CC(N(Cc3ccc(cc3)[Cl])c3ccccc3S2(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9281 |
| logD: | 4.9281 |
| logSw: | -4.8512 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.273 |
| InChI Key: | UFBLXZNIGHVXFM-UHFFFAOYSA-N |