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19083-35-3 | Thymidine, α-(phenylmethoxy)-
CAS No: 19083-35-3 Catalog No: AG002EUS MDL No:
Product Description
Catalog Number:
AG002EUS
Chemical Name:
Thymidine, α-(phenylmethoxy)-
CAS Number:
19083-35-3
Molecular Formula:
C17H20N2O6
Molecular Weight:
348.3505
IUPAC Name:
1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(phenylmethoxymethyl)pyrimidine-2,4-dione
InChI:
InChI=1S/C17H20N2O6/c20-8-14-13(21)6-15(25-14)19-7-12(16(22)18-17(19)23)10-24-9-11-4-2-1-3-5-11/h1-5,7,13-15,20-21H,6,8-10H2,(H,18,22,23)
InChI Key:
GQDUJQWJZIRFKA-UHFFFAOYSA-N
SMILES:
OC[C@H]1O[C@H](C[C@@H]1O)n1cc(COCc2ccccc2)c(=O)[nH]c1=O
Properties
Complexity:
531
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.132g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
348.355g/mol
Monoisotopic Mass:
348.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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