6737-0617 Screening compound: 5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl]-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol

6737-0617 Screening compound: 5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl]-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
6737-0617 Screening compound: 5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl]-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6737-0617
5-amino-3-[(2-methylprop-2-en-1-yl)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

6737-0617

Molecular Formula

C9H11N5OS (C9 H11 N5 OS)

Compound Name

5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl]-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol

IUPAC name

5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl]-[124]triazolo[43-a]pyrimidin-7-ol

SMILES

CC(CSc(n1c(N)c2)nnc1nc2O)=C

InChI

InChI=1S/C9H11N5OS/c1-5(2)4-16-9-13-12-8-11-7(15)3-6(10)14(8)9/h3H,1,4,10H2,2H3,(H,11,12,15)

InChI Key

KQBGLDGHXDDYHO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

237.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.054

Distribution Coefficient, logD

0.838

Water Solubility, LogSw

-1.50

Polar Surface Area

69.338

Acid Dissociation Constant (pKa)

7.59

Base Dissociation Constant (pKb)

1.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 6737-0617 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6737-0617?
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What is the minimum amount of 6737-0617 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6737-0617
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6737-0617
  • 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 6737-0617 available by request