L741-2006 Screening compound: 1-(2-chlorophenyl)-N-[(4-chlorophenyl)methyl]-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide

L741-2006 Screening compound: 1-(2-chlorophenyl)-N-[(4-chlorophenyl)methyl]-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
L741-2006 Screening compound: 1-(2-chlorophenyl)-N-[(4-chlorophenyl)methyl]-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L741-2006
1-(2-chlorophenyl)-N-[(4-chlorophenyl)methyl]-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide

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

L741-2006

Molecular Formula

C21H15Cl2N5O (C21 H15 Cl2 N5 O)

Compound Name

1-(2-chlorophenyl)-N-[(4-chlorophenyl)methyl]-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide

IUPAC name

1-(2-chlorophenyl)-N-[(4-chlorophenyl)methyl]-5-(pyridin-4-yl)-1H-123-triazole-4-carboxamide

SMILES

O=C(c1c(-c2ccncc2)n(-c(cccc2)c2Cl)nn1)NCc(cc1)ccc1Cl

InChI

InChI=1S/C21H15Cl2N5O/c22-16-7-5-14(6-8-16)13-25-21(29)19-20(15-9-11-24-12-10-15)28(27-26-19)18-4-2-1-3-17(18)23/h1-12H,13H2,(H,25,29)

InChI Key

HDKSUIFLLXSJDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27473580

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.674

Distribution Coefficient, logD

3.674

Water Solubility, LogSw

-4.14

Polar Surface Area

59.380

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

3.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

L741-2006 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L741-2006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L741-2006?
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What is the minimum amount of L741-2006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L741-2006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L741-2006
  • 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 L741-2006 available by request