sodium--{[4-({[(2,6-dichlorophenyl)methyl](4-methoxybenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
Chemical Structure Depiction of
sodium--{[4-({[(2,6-dichlorophenyl)methyl](4-methoxybenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
sodium--{[4-({[(2,6-dichlorophenyl)methyl](4-methoxybenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
Compound characteristics
| Compound ID: | K783-1641 |
| Compound Name: | sodium--{[4-({[(2,6-dichlorophenyl)methyl](4-methoxybenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1) |
| Molecular Weight: | 523.41 |
| Molecular Formula: | C22 H25 Cl2 N2 O5 S |
| Salt: | Na+ |
| Smiles: | COc1ccc(cc1)S(N(CC1CCC(CC1)C(N[O-])=O)Cc1c(cccc1[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5896 |
| logD: | 4.5896 |
| logSw: | -4.4261 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.003 |
| InChI Key: | PVKQIINSRLKMLU-UHFFFAOYSA-N |