D3-Thymidine

CAT: 0926-NT08812-04Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0926-NT08812-04Size:10 mg

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CAS Number

74848-84-3

MDL Number

MFCD01317525

Smiles

[2H]C ([2H]) ([2H]) C1=CN (C (=O) NC1=O) [C@H]2C[C@@H] ([C@H] (O2) CO) O

Molecular Formula

C10H11N2O5D3

Molecular Weight

245.25 g/mol

Controlled

Chemical Information

Thymidine-d3

CAS Number	74848-84-3
PubChem CID	46783076
IUPAC Name	1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trideuteriomethyl)pyrimidine-2,4-dione
Molecular Formula	C10H14N2O5
Molecular Weight	245.25
XLogP	-1.2
Topological Polar Surface Area	99.1
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Heavy Atom Count	17
Formal Charge	0
Complexity	381

SMILES

[2H]C([2H])([2H])C1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O

InChI

InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m0/s1/i1D3

InChIKey

IQFYYKKMVGJFEH-BXKFBODDSA-N

Chemical Structure

2D Structure

CAS: 74848-84-3

CID: 46783076

Formula: C10H14N2O5

MW: 245.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	245.25
XLogP3	-1.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	245.10910179
Monoisotopic Mass	245.10910179
Topological Polar Surface Area	99.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	381
Isotope Atom Count	3
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
Compound Is Canonicalized	Yes

Catalog	Name
NT00283-01	α-Thymidine
NT02592-01	Thymidine
TCA94198	Thymine-d3
NT02679-01	L-Thymidine
NT29046-01	Thymidine-a, a, a,6-D4
XV184544-01	Vitamin D3-d3
SYB68355-01	Danofloxacin d3 (methyl d3)
UIA53368-01	Heroin-d3 (diacetylmorphine-d3)
NT05748-01	Thymidine-5'-triphosphate trisodium
ND146115-01	5'-O-DMT-α-thymidine