sodium--{[4-({[(3-bromophenyl)methyl](4-tert-butylbenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
Chemical Structure Depiction of
sodium--{[4-({[(3-bromophenyl)methyl](4-tert-butylbenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
sodium--{[4-({[(3-bromophenyl)methyl](4-tert-butylbenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1)
Compound characteristics
| Compound ID: | K783-4064 |
| Compound Name: | sodium--{[4-({[(3-bromophenyl)methyl](4-tert-butylbenzene-1-sulfonyl)amino}methyl)cyclohexane-1-carbonyl]amino}oxidanide (1/1) |
| Molecular Weight: | 559.5 |
| Molecular Formula: | C25 H32 Br N2 O4 S |
| Salt: | Na+ |
| Smiles: | CC(C)(C)c1ccc(cc1)S(N(CC1CCC(CC1)C(N[O-])=O)Cc1cccc(c1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.924 |
| logD: | 5.924 |
| logSw: | -5.4686 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.46 |
| InChI Key: | MMGVGWBFCVEHMT-UHFFFAOYSA-N |