D205-0124 Screening compound: 2-{6-chloro-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

D205-0124 Screening compound: 2-{6-chloro-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
D205-0124 Screening compound: 2-{6-chloro-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D205-0124
2-{6-chloro-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

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

D205-0124

Molecular Formula

C16H10ClN5O4 (C16 H10 ClN5 O4)

Compound Name

2-{6-chloro-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

IUPAC name

2-{6-chloro-57-dimethyl-[124]triazolo[15-a]pyrimidin-2-yl}-13-dioxo-23-dihydro-1H-isoindole-5-carboxylic acid

SMILES

Cc(n1nc(N(C(c(cc2)c3cc2C(O)=O)=O)C3=O)nc1nc1C)c1Cl

InChI

InChI=1S/C16H10ClN5O4/c1-6-11(17)7(2)22-15(18-6)19-16(20-22)21-12(23)9-4-3-8(14(25)26)5-10(9)13(21)24/h3-5H,1-2H3,(H,25,26)

InChI Key

JLDSZBKYLQWJDV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14813905

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.74

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.439

Distribution Coefficient, logD

-1.538

Water Solubility, LogSw

-3.11

Polar Surface Area

87.352

Acid Dissociation Constant (pKa)

3.42

Base Dissociation Constant (pKb)

-0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with D205-0124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D205-0124?
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What is the minimum amount of D205-0124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D205-0124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D205-0124
  • 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 D205-0124 available by request