2-(benzenesulfonamido)-N,N'-dicarbamoyl-pentanediamide
Basic information
- CAS
1031702-84-7- Standard SMILES
NC(=O)NC(=O)CCC(NS(=O)(=O)c1ccccc1)C(=O)NC(N)=O- InChIKey
PKSDWZOTBKOKES-UHFFFAOYSA-N- Molecular formula
- C13H17N5O6S
- Average molar mass
- 371.37 g/mol
- Monoisotopic mass
- 371.08995445
Names & identifiers
- Preferred name
- 2-(benzenesulfonamido)-N,N'-dicarbamoyl-pentanediamide
- IUPAC
- 2-(benzenesulfonamido)-N,N'-dicarbamoylpentanediamide
Names & synonyms
NSC6832402-(benzenesulfonamido)-N,N'-dicarbamoyl-pentanediamideCHEMBL2004858DTXSID201170147NSC-6832401031702-84-7NCI60_0297992-(Benzene sulfonyl)-L-glutamic acid urideN~2~-(Benzenesulfonyl)-N~1~,N~5~-dicarbamoylglutamamideN1,N5-Bis(aminocarbonyl)-2-[(phenylsulfonyl)amino]pentanediamideN-(4-((Aminocarbonyl)amino)-1-(((aminocarbonyl)amino)carbonyl)-4-oxobutyl)benzenesulfonamide
Database identifiers
- CAS
1031702-84-7- PubChem CID
- 388356
- DTXSID
DTXSID201170147- ChEMBL
CHEMBL2004858
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 199 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 623
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Compound notes
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