6404-0192 Screening compound: 5-amino-3-{[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol

6404-0192 Screening compound: 5-amino-3-{[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
6404-0192 Screening compound: 5-amino-3-{[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6404-0192
5-amino-3-{[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]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

6404-0192

Molecular Formula

C13H11N9OS (C13 H11 N9 OS)

Compound Name

5-amino-3-{[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol

IUPAC name

5-amino-3-{[(1-phenyl-1H-1234-tetrazol-5-yl)methyl]sulfanyl}-[124]triazolo[43-a]pyrimidin-7-ol

SMILES

Nc(n12)cc(O)nc2nnc1SCc1nnnn1-c1ccccc1

InChI

InChI=1S/C13H11N9OS/c14-9-6-11(23)15-12-17-18-13(21(9)12)24-7-10-16-19-20-22(10)8-4-2-1-3-5-8/h1-6H,7,14H2,(H,15,17,23)

InChI Key

CTSDWSGIKBIIBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04214198

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.399

Distribution Coefficient, logD

0.184

Water Solubility, LogSw

-1.25

Polar Surface Area

109.383

Acid Dissociation Constant (pKa)

7.59

Base Dissociation Constant (pKb)

1.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

References: we are preparing a list of scientific research reports with 6404-0192 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6404-0192?
Check Price and Availability of 6404-0192, 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 6404-0192 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6404-0192
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6404-0192
  • 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 6404-0192 available by request