N-[(4-chlorophenyl)methyl]-2-{1,1,3-trioxo-2-[4-(propan-2-yl)phenyl]-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-{1,1,3-trioxo-2-[4-(propan-2-yl)phenyl]-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
N-[(4-chlorophenyl)methyl]-2-{1,1,3-trioxo-2-[4-(propan-2-yl)phenyl]-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
Compound characteristics
| Compound ID: | K261-3032 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-{1,1,3-trioxo-2-[4-(propan-2-yl)phenyl]-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide |
| Molecular Weight: | 498 |
| Molecular Formula: | C25 H24 Cl N3 O4 S |
| Smiles: | CC(C)c1ccc(cc1)N1C(N(CC(NCc2ccc(cc2)[Cl])=O)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1712 |
| logD: | 5.1712 |
| logSw: | -5.6979 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.214 |
| InChI Key: | DKFXOLXTORCTRN-UHFFFAOYSA-N |