Product name: 5，6-Dihydro-5-Azathymidine
Synonyms:
DHAdT
5,6-Dihydro-5-azathymidine
AIDS212547
AIDS-212547
Properties Computed from Structure:
Molecular Weight 273.28566 [g/mol]
Molecular Formula C11H19N3O5
XLogP -0.8
H-Bond Donor 3
H-Bond Acceptor 5
Rotatable Bond Count 2
Tautomer Count 3
Exact Mass 273.132471
MonoIsotopic Mass 273.132471
Topological Polar Surface Area 102
Heavy Atom Count 19
Formal Charge 0
Complexity 400
Isotope Atom Count 0
Defined Atom StereoCenter Count 3
Undefined Atom StereoCenter Count 0
Defined Bond StereoCenter Count 0
Undefined Bond StereoCenter Count 0
Covalently-Bonded Unit Count 1
Descriptors Computed from Structure:
IUPAC Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,6,6-trimethyl-1,
3,5-triazinane-2,4-dione
Canonical SMILES: CC1(N(C(=O)NC(=O)N1C2CC(C(O2)CO)O)C)C
Isomeric SMILES: CC1(N(C(=O)NC(=O)N1[C@H]2C[C@@H]([C@H](O2)CO)O)C)C
InChI: InChI=1/C11H19N3O5/c1-11(2)13(3)9(17)12-10(18)14(11)8-4-6(16)7(5-15)19-
8/h6-8,15-16H,4-5H2,1-3H3,(H,12,17,18)/t6-,7+,8+/m0/s1/f/h12H