LY 544349 sodium tetrahydrate
Properties
- Molecular formula
- C20H29N2NaO11S
- Molar mass
- 528.50 g/mol
- Exact mass
- 528.1390 Da
- logP
- -0.85Crippen estimate
- Polar surface area
- 268.4 Ų
- H-bond donors / acceptors
- 3 / 6
- Rotatable bonds
- 7
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
201677-61-4SMILES
CC(C)(C)C(=O)Oc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCC([O-])=O)cc1.O.O.O.O.[Na+]InChI
The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.
Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Propanoic acid, 2,2-dimethyl-, 4-[[[2-[[(carboxymethyl)amino]carbonyl]phenyl]amino]sulfonyl]phenyl ester, sodium salt, hydrate (1:1:4)
- Glycine, N-[2-[[[4-(2,2-dimethyl-1-oxopropoxy)phenyl]sulfonyl]amino]benzoyl]-, monosodium salt, tetrahydrate
- Sivelestat sodium tetrahydrate
- Elaspol 100
- Elaspol
Work with LY 544349 sodium tetrahydrate
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Sodium hippurate532-94-539 % similar
Sodium p-aminohippurate94-16-635 % similar
Sodium N-[8-(2-hydroxybenzoyl)amino]caprylate203787-91-132 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.