CM2843-5705 Screening compound: 3-[1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole

CM2843-5705 Screening compound: 3-[1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole
CM2843-5705 Screening compound: 3-[1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound CM2843-5705
3-[1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole

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

CM2843-5705

Molecular Formula

C14H20N6O (C14 H20 N6 O)

Compound Name

3-[1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-1,2,4-triazole

IUPAC name

3-[1-(3-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-2-yl]-4-(propan-2-yl)-4H-124-triazole

SMILES

CC(C)n1c(C(CCC2)N2C(c2cc(C)n[nH]2)=O)nnc1

InChI

InChI=1S/C14H20N6O/c1-9(2)20-8-15-18-13(20)12-5-4-6-19(12)14(21)11-7-10(3)16-17-11/h7-9,12H,4-6H2,1-3H3,(H,16,17)/t12-/m0/s1

InChI Key

FOKSEBNLRAVQON-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD30465812

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.637

Distribution Coefficient, logD

0.637

Water Solubility, LogSw

-1.31

Polar Surface Area

64.662

Acid Dissociation Constant (pKa)

8.94

Base Dissociation Constant (pKb)

2.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.14

CM2843-5705 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with CM2843-5705 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM2843-5705?
Check Price and Availability of CM2843-5705, 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 CM2843-5705 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM2843-5705
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM2843-5705
  • 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 CM2843-5705 available by request