chempirical

Psi 7411

C10H14FN2O8PCAS 1015073-43-4340.20 g/mol

Open in Covalent MOL file
FHOOPOHOHOONOHNO
AlcoholAlkyl halideEtherPhenolPhosphate

Properties

Molecular formula
C10H14FN2O8P
Molar mass
340.20 g/mol
Exact mass
340.0472 Da
logP
-0.96Crippen estimate
Polar surface area
151.3 Ų
H-bond donors / acceptors
4 / 7
Rotatable bonds
4
Stereocentres
R, R, R, Rin SMILES atom order

Identifiers

CAS number
1015073-43-4
SMILES
C[C@@]1(F)[C@H](O)[C@@H](COP(=O)(O)O)O[C@H]1n1ccc(O)nc1=O
InChIKey
JAJZLQMRDFLNSW-VPCXQMTMSA-N
InChI
InChI=1S/C10H14FN2O8P/c1-10(11)7(15)5(4-20-22(17,18)19)21-8(10)13-3-2-6(14)12-9(13)16/h2-3,5,7-8,15H,4H2,1H3,(H,12,14,16)(H2,17,18,19)/t5-,7-,8-,10-/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names
  • 5′-Uridylic acid, 2′-deoxy-2′-fluoro-2′-methyl-, (2′R)-
  • (2′R)-2′-Deoxy-2′-fluoro-2′-methyl-5′-uridylic acid

Work with Psi 7411

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(2′R)-2′-Deoxy-2′-fluoro-2′-methyluridine863329-66-272 % similar Uridine monophosphate58-97-962 % similar Sofosbuvir1190307-88-058 % similar Uridine diphosphate58-98-052 % similar Uridine triphosphate63-39-851 % similar Diquafosol59985-21-648 % similar Disodium ump3387-36-847 % similar 2′-Deoxy-2′-fluoro-2′-C-methylcytidine817204-33-447 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook