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2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol structure
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2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol

TL;DR: 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol (CAS 159599-43-6) is a chemical compound with molecular formula C13H14N6O and molecular weight 270.1229 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(3-benzyltriazolo[4,5-d]pyrimidin-7-yl)amino]ethanol

Also Known As: ASN 07369592, 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol, 2-[(3-benzyltriazolo[4,5-d]pyrimidin-7-yl)amino]ethanol, 2-[[3-(Phenylmethyl)-3H-1,2,3-triazolo[4,5-d]pyrimidin-7-yl]amino]ethanol

CAS Number
159599-43-6
Molecular Formula
C13H14N6O
Molecular Weight
270.1229 g/mol
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Technical Specifications

Molecular FormulaC13H14N6O
Molecular Weight270.1229 g/mol
XLogP1.0
Topological Polar Surface Area (TPSA)88.8 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds5
Exact Mass270.1229 Da
Heavy Atoms20
Complexity299.0
SMILESC1=CC=C(C=C1)CN2C3=NC=NC(=C3N=N2)NCCO
InChIKeyVBQBRXDKLWZEPA-UHFFFAOYSA-N

Chemical Property Profile of 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol

XLogP
1.0
TPSA (Topological Polar Surface Area)
88.8
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
5
Heavy Atoms
20
Complexity
299.0
Exact Mass
270.1229
Monoisotopic Mass
270.1229
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol

The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol. Following Lipinski's Rule of Five, 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol?

The CAS number of 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol is 159599-43-6.

What is the molecular formula of 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol?

The molecular formula of 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol is C13H14N6O.

What is the molecular weight of 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol?

The molecular weight of 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol is 270.1229 g/mol.

Where can I buy 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol?

You can request a quote for 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol?

Yes, CoreyChem provides custom synthesis services for 2-(3-Benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ylamino)-ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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