Butanediamide, N-(3-hydroxypropyl)-N'-(4-((((oxo(2-phenylethyl)amino)acetyl)amino)sulfonyl)phenyl)-
Basic information
- CAS
85877-95-8- Standard SMILES
O=C(CCC(=O)Nc1ccc(S(=O)(=O)NC(=O)C(=O)NCCc2ccccc2)cc1)NCCCO- InChIKey
SBVSHDFLNAACLL-UHFFFAOYSA-N- Molecular formula
- C23H28N4O7S
- Average molar mass
- 504.6 g/mol
- Monoisotopic mass
- 504.16787042
Names & identifiers
- Preferred name
- Butanediamide, N-(3-hydroxypropyl)-N'-(4-((((oxo(2-phenylethyl)amino)acetyl)amino)sulfonyl)phenyl)-
- IUPAC
- N-(3-hydroxypropyl)-N'-[4-[[2-oxo-2-(2-phenylethylamino)acetyl]sulfamoyl]phenyl]butanediamide
Names & synonyms
Butanediamide, N-(3-hydroxypropyl)-N'-(4-((((oxo(2-phenylethyl)amino)acetyl)amino)sulfonyl)phenyl)-N-(3-Hydroxypropyl)-N'-(4-((N(sup 2)-phenethyloxamido)sulfonyl)phenyl)butanediamine85877-95-8DTXSID30235186RefChem:330552DTXCID30157677N~1~-(3-Hydroxypropyl)-N~4~-[4-({oxo[(2-phenylethyl)amino]acetyl}sulfamoyl)phenyl]butanediamide
Database identifiers
- CAS
85877-95-8- PubChem CID
- 3070150
- DTXSID
DTXSID30235186
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 179 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 814
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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