8016-8207 Screening compound: 3-benzyl-5-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol

8016-8207 Screening compound: 3-benzyl-5-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
8016-8207 Screening compound: 3-benzyl-5-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-8207
3-benzyl-5-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8016-8207

Molecular Formula

C12H11N5O (C12 H11 N5 O)

Compound Name

3-benzyl-5-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol

IUPAC name

3-benzyl-5-methyl-3H-[123]triazolo[45-d]pyrimidin-7-ol

SMILES

Cc(nc1O)nc2c1nnn2Cc1ccccc1

InChI

InChI=1S/C12H11N5O/c1-8-13-11-10(12(18)14-8)15-16-17(11)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,13,14,18)

InChI Key

LHLLYOFPMYOQAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03753698

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

241.25

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.003

Distribution Coefficient, logD

0.115

Water Solubility, LogSw

-0.84

Polar Surface Area

62.438

Acid Dissociation Constant (pKa)

6.57

Base Dissociation Constant (pKb)

1.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

8016-8207 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8016-8207 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-8207?
Check Price and Availability of 8016-8207, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8016-8207 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-8207
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-8207
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8016-8207 available by request