2-[(3-chlorophenyl)methyl]-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
2-[(3-chlorophenyl)methyl]-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
2-[(3-chlorophenyl)methyl]-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | F475-0059 |
| Compound Name: | 2-[(3-chlorophenyl)methyl]-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 452.88 |
| Molecular Formula: | C21 H16 Cl F3 N2 O2 S |
| Smiles: | C(c1cccc(c1)[Cl])N1C(c2ccc(cc2)C(F)(F)F)Nc2ccccc2S1(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6429 |
| logD: | 5.6429 |
| logSw: | -6.2905 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.035 |
| InChI Key: | DCBSDIWHWFCESI-FQEVSTJZSA-N |