L806-0264 Screening compound: 3-[1-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-5-yl]pyridine

L806-0264 Screening compound: 3-[1-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-5-yl]pyridine
L806-0264 Screening compound: 3-[1-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-5-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound L806-0264
3-[1-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-5-yl]pyridine

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

L806-0264

Molecular Formula

C18H16ClN5O (C18 H16 ClN5 O)

Compound Name

3-[1-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-5-yl]pyridine

IUPAC name

3-[1-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)-1H-123-triazol-5-yl]pyridine

SMILES

O=C(c1c(-c2cnccc2)n(-c(cccc2)c2Cl)nn1)N1CCCC1

InChI

InChI=1S/C18H16ClN5O/c19-14-7-1-2-8-15(14)24-17(13-6-5-9-20-12-13)16(21-22-24)18(25)23-10-3-4-11-23/h1-2,5-9,12H,3-4,10-11H2

InChI Key

IQJQYYUZUMMIAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27476272

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.81

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.382

Distribution Coefficient, logD

2.382

Water Solubility, LogSw

-2.83

Polar Surface Area

52.071

Acid Dissociation Constant (pKa)

27.06

Base Dissociation Constant (pKb)

2.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

L806-0264 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SH2 Library (10483 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with L806-0264 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L806-0264?
Check Price and Availability of L806-0264, 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 L806-0264 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L806-0264
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L806-0264
  • 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 L806-0264 available by request