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3’-Amino-3’-deoxythymidine

CAT: 0572-TRC-A604250-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-A604250-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
52450-18-7
Synonyms
Thymidine, 3'-amino-3'-deoxy-; 3'-Amino-3'-deoxythymidine; 3'-Deoxy-3'-aminothymidine; AMT; AMT (pharmaceutical); 3-amino-3 deoxythymidine (674U78) GR 234003X
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
CC1=CN([C@H]2C[C@H](N)[C@@H](CO)O2)C(=O)NC1=O
Molecular Formula
C10 H15 N3 O4
Molecular Weight
241.24
InChI
InChI=1S/C10H15N3O4/c1-5-3-13(10(16)12-9(5)15)8-2-6(11)7(4-14)17-8/h3,6-8,14H,2,4,11H2,1H3,(H,12,15,16)/t6-,7+,8+/m0/s1
Additionnal Information
IUPAC name: 1-[(2R,4S,5S)-4-amino-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

3'-Aminothymidine

do not confuse with 3-aminothymidine

CAS Number52450-18-7
PubChem CID108074
IUPAC Name1-[(2R,4S,5S)-4-amino-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Molecular FormulaC10H15N3O4
Molecular Weight241.24
XLogP-1
Topological Polar Surface Area105
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity382
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N
InChI
InChI=1S/C10H15N3O4/c1-5-3-13(10(16)12-9(5)15)8-2-6(11)7(4-14)17-8/h3,6-8,14H,2,4,11H2,1H3,(H,12,15,16)/t6-,7+,8+/m0/s1
InChIKey
ADVCGXWUUOVPPB-XLPZGREQSA-N
Chemical Structure
2D Structure
2D structure of 3'-Aminothymidine
CAS: 52450-18-7
CID: 108074
Formula: C10H15N3O4
MW: 241.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight241.24
XLogP3-1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass241.10625597
Monoisotopic Mass241.10625597
Topological Polar Surface Area105 Ų
Heavy Atom Count17
Formal Charge0
Complexity382
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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