D-Valine, N-[(4-fluorophenyl)sulfonyl]-
Basic information
- CAS
190275-60-6- Standard SMILES
CC(C)[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)O- InChIKey
VNRQLAGSSZUTTO-SNVBAGLBSA-N- Molecular formula
- C11H14FNO4S
- Average molar mass
- 275.3 g/mol
- Monoisotopic mass
- 275.06275726
Names & identifiers
- Preferred name
- D-Valine, N-[(4-fluorophenyl)sulfonyl]-
- IUPAC
- (2R)-2-[(4-fluorophenyl)sulfonylamino]-3-methylbutanoic acid
Names & synonyms
D-Valine, N-[(4-fluorophenyl)sulfonyl]-190275-60-6(2R)-2-[(4-fluorophenyl)sulfonylamino]-3-methylbutanoic acidN-[(4-fluorophenyl)sulfonyl]-D-valineSCHEMBL6797666DTXSID70353212VNRQLAGSSZUTTO-SNVBAGLBSA-NEiM07-30000AKOS017539704N-[(4-fluorophenyl)-sulfonyl]-D-valineN-(4-Fluorobenzene-1-sulfonyl)-D-valine(R)-2-(4-Fluorophenylsulfonamido)-3-methylbutanoic acid
Database identifiers
- CAS
190275-60-6- PubChem CID
- 737247
- DTXSID
DTXSID70353212- Nikkaji
- J2.210.423C
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 382
Related reactions
3 records
Compound notes
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