N-[(2-chlorophenyl)methyl]-4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3-methylbutanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3-methylbutanamide
N-[(2-chlorophenyl)methyl]-4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3-methylbutanamide
Compound characteristics
Compound ID: | K261-0657 |
Compound Name: | N-[(2-chlorophenyl)methyl]-4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3-methylbutanamide |
Molecular Weight: | 405.9 |
Molecular Formula: | C19 H20 Cl N3 O3 S |
Smiles: | CC(CC1NS(c2ccccc2N=1)(=O)=O)CC(NCc1ccccc1[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8321 |
logD: | 2.3921 |
logSw: | -3.4338 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.096 |
InChI Key: | RVQMVYKFSHZPJL-CYBMUJFWSA-N |