4-benzyl-3-{[(4-chlorophenyl)methyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-benzyl-3-{[(4-chlorophenyl)methyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
4-benzyl-3-{[(4-chlorophenyl)methyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Compound characteristics
Compound ID: | K261-2809 |
Compound Name: | 4-benzyl-3-{[(4-chlorophenyl)methyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione |
Molecular Weight: | 428.96 |
Molecular Formula: | C21 H17 Cl N2 O2 S2 |
Smiles: | C(c1ccccc1)N1C(=NS(c2ccccc12)(=O)=O)SCc1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 5.1314 |
logD: | 5.1314 |
logSw: | -5.6348 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 43.713 |
InChI Key: | SWGHQMNYLYLZLL-UHFFFAOYSA-N |