2-[(4-methoxyphenyl)methyl]-3-[4-(methylsulfanyl)phenyl]-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
2-[(4-methoxyphenyl)methyl]-3-[4-(methylsulfanyl)phenyl]-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
2-[(4-methoxyphenyl)methyl]-3-[4-(methylsulfanyl)phenyl]-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | F475-0486 |
| Compound Name: | 2-[(4-methoxyphenyl)methyl]-3-[4-(methylsulfanyl)phenyl]-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C22 H22 N2 O3 S2 |
| Smiles: | COc1ccc(CN2C(c3ccc(cc3)SC)Nc3ccccc3S2(=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8164 |
| logD: | 4.8164 |
| logSw: | -4.5471 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.579 |
| InChI Key: | XRPJKGIQBDMFQK-QFIPXVFZSA-N |