N'-(Cholestan-3-ylidene)-4-methylbenzene-1-sulfonohydrazide
Basic information
- CAS
37826-48-5- Standard SMILES
Cc1ccc(S(=O)(=O)NN=C2CCC3(C)C(CCC4C3CCC3(C)C(C(C)CCCC(C)C)CCC43)C2)cc1- InChIKey
WEYZMRCZHLHLOW-UHFFFAOYSA-N- Molecular formula
- C34H54N2O2S
- Average molar mass
- 554.9 g/mol
- Monoisotopic mass
- 554.39060014
Names & identifiers
- Preferred name
- N'-(Cholestan-3-ylidene)-4-methylbenzene-1-sulfonohydrazide
- IUPAC
- N-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]amino]-4-methylbenzenesulfonamide
Names & synonyms
37826-48-5DTXSID60958856N'-(Cholestan-3-ylidene)-4-methylbenzene-1-sulfonohydrazide
Database identifiers
- CAS
37826-48-5- PubChem CID
- 280416
- DTXSID
DTXSID60958856
Properties
Computed structural properties
- XLogP
- 10.4
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 978
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Compound notes
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