sodium--[4-({[(2-methylphenyl)methyl][3-(trifluoromethyl)benzene-1-sulfonyl]amino}methyl)benzamido]oxidanide (1/1)
Chemical Structure Depiction of
sodium--[4-({[(2-methylphenyl)methyl][3-(trifluoromethyl)benzene-1-sulfonyl]amino}methyl)benzamido]oxidanide (1/1)
sodium--[4-({[(2-methylphenyl)methyl][3-(trifluoromethyl)benzene-1-sulfonyl]amino}methyl)benzamido]oxidanide (1/1)
Compound characteristics
| Compound ID: | K783-3534 |
| Compound Name: | sodium--[4-({[(2-methylphenyl)methyl][3-(trifluoromethyl)benzene-1-sulfonyl]amino}methyl)benzamido]oxidanide (1/1) |
| Molecular Weight: | 500.47 |
| Molecular Formula: | C23 H20 F3 N2 O4 S |
| Salt: | Na+ |
| Smiles: | Cc1ccccc1CN(Cc1ccc(cc1)C(N[O-])=O)S(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.454 |
| logD: | 4.454 |
| logSw: | -4.2815 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.267 |
| InChI Key: | YIMWNGDOOBDBSU-UHFFFAOYSA-N |