M032-0037 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide

M032-0037 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
M032-0037 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M032-0037
N-[2-(4-chlorophenyl)ethyl]-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide

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

M032-0037

Molecular Formula

C18H17ClN4O (C18 H17 ClN4 O)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-3-[(1H-1,2,4-triazol-1-yl)methyl]benzamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-3-[(1H-124-triazol-1-yl)methyl]benzamide

SMILES

O=C(c1cc(Cn2ncnc2)ccc1)NCCc(cc1)ccc1Cl

InChI

InChI=1S/C18H17ClN4O/c19-17-6-4-14(5-7-17)8-9-21-18(24)16-3-1-2-15(10-16)11-23-13-20-12-22-23/h1-7,10,12-13H,8-9,11H2,(H,21,24)

InChI Key

IJSURBGHQULCOY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15139193

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.81

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.074

Distribution Coefficient, logD

2.074

Water Solubility, LogSw

-3.22

Polar Surface Area

49.470

Acid Dissociation Constant (pKa)

12.53

Base Dissociation Constant (pKb)

1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

M032-0037 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with M032-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M032-0037?
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What is the minimum amount of M032-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M032-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M032-0037
  • 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 M032-0037 available by request