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N4-Ethyl-2'-deoxycytidine

CAT: 0931-TNU1613-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TNU1613-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
70465-61-1
Target
Nucleoside Antimetabolite/Analog, Others
Related Pathways
Cell Cycle/Checkpoint, Others, DNA Damage/DNA Repair
Bioactivity
N4-Ethyl-2'-deoxycytidine is a Nucleoside Derivative - N-Methylated alkylated nucleoside.
Smiles
O=C1N([C@@H]2O[C@H](CO)[C@@H](O)C2)C=CC(NCC)=N1
Molecular Formula
C11H17N3O4
Molecular Weight
255.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N4-Ethyl-2'-deoxycytidine
CAS Number70465-61-1
PubChem CID11425350
IUPAC Name4-(ethylamino)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Molecular FormulaC11H17N3O4
Molecular Weight255.27
XLogP-1
Topological Polar Surface Area94.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity382
SMILES
CCNC1=NC(=O)N(C=C1)[C@H]2C[C@@H]([C@H](O2)CO)O
InChI
InChI=1S/C11H17N3O4/c1-2-12-9-3-4-14(11(17)13-9)10-5-7(16)8(6-15)18-10/h3-4,7-8,10,15-16H,2,5-6H2,1H3,(H,12,13,17)/t7-,8+,10+/m0/s1
InChIKey
RNLZVUVMQXRIHF-QXFUBDJGSA-N
Chemical Structure
2D Structure
2D structure of N4-Ethyl-2'-deoxycytidine
CAS: 70465-61-1
CID: 11425350
Formula: C11H17N3O4
MW: 255.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight255.27
XLogP3-1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass255.12190603
Monoisotopic Mass255.12190603
Topological Polar Surface Area94.4 Ų
Heavy Atom Count18
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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Alternative Products

CatalogName
VCA46561-01N4-Ethyl-2'-deoxycytidine
HY-154472-01N4-Ethyl-2’-deoxycytidine
460375-01N4-Ethyl-2’-deoxycytidine discontinued
NA08263-01N4-Acetyl-2'-deoxycytidine
296091-01N4-Etheno 2'-deoxycytidine
295412-01N4-Benzoyl-2'-deoxycytidine
TRC-N633050-10MGN4-Anisoyl-2'-deoxycytidine
sc-222028N4-Isobutyryl-2'-deoxycytidine
M21271-01N4-Benzoyl-2′-deoxycytidine
MBS3611256-01N4-Benzoyl-2?-deoxycytidine

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