4-butyl-3-{[(3-methoxyphenyl)methyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-butyl-3-{[(3-methoxyphenyl)methyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
4-butyl-3-{[(3-methoxyphenyl)methyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Compound characteristics
Compound ID: | K261-2546 |
Compound Name: | 4-butyl-3-{[(3-methoxyphenyl)methyl]sulfanyl}-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione |
Molecular Weight: | 390.52 |
Molecular Formula: | C19 H22 N2 O3 S2 |
Smiles: | CCCCN1C(=NS(c2ccccc12)(=O)=O)SCc1cccc(c1)OC |
Stereo: | ACHIRAL |
logP: | 4.5311 |
logD: | 4.5311 |
logSw: | -4.1907 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.507 |
InChI Key: | SCFWREPDPZSDIY-UHFFFAOYSA-N |