L741-2826 Screening compound: [1-(3-ethylphenyl)-5-(4-pyridyl)-1H-1,2,3-triazol-4-yl](4-isopropylpiperazino)methanone

L741-2826 Screening compound: [1-(3-ethylphenyl)-5-(4-pyridyl)-1H-1,2,3-triazol-4-yl](4-isopropylpiperazino)methanone
L741-2826 Screening compound: [1-(3-ethylphenyl)-5-(4-pyridyl)-1H-1,2,3-triazol-4-yl](4-isopropylpiperazino)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound L741-2826
[1-(3-ethylphenyl)-5-(4-pyridyl)-1H-1,2,3-triazol-4-yl](4-isopropylpiperazino)methanone

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

L741-2826

Molecular Formula

C23H28N6O (C23 H28 N6 O)

Compound Name

[1-(3-ethylphenyl)-5-(4-pyridyl)-1H-1,2,3-triazol-4-yl](4-isopropylpiperazino)methanone

IUPAC name

1-[1-(3-ethylphenyl)-5-(pyridin-4-yl)-1H-123-triazole-4-carbonyl]-4-(propan-2-yl)piperazine

SMILES

CCc1cccc(-n2nnc(C(N(CC3)CCN3C(C)C)=O)c2-c2ccncc2)c1

InChI

InChI=1S/C23H28N6O/c1-4-18-6-5-7-20(16-18)29-22(19-8-10-24-11-9-19)21(25-26-29)23(30)28-14-12-27(13-15-28)17(2)3/h5-11,16-17H,4,12-15H2,1-3H3

InChI Key

JBMMSUTXJOJJHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27473616

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.760

Distribution Coefficient, logD

2.424

Water Solubility, LogSw

-2.66

Polar Surface Area

55.780

Acid Dissociation Constant (pKa)

25.62

Base Dissociation Constant (pKb)

7.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.13

L741-2826 in Drug Discovery

Included in Screening Libraries

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with L741-2826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L741-2826?
Check Price and Availability of L741-2826, 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 L741-2826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L741-2826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L741-2826
  • 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 L741-2826 available by request