M598-1589 Screening compound: 4-chloro-2-methoxy-N~1~-{[5-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}benzamide

M598-1589 Screening compound: 4-chloro-2-methoxy-N~1~-{[5-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}benzamide
M598-1589 Screening compound: 4-chloro-2-methoxy-N~1~-{[5-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M598-1589
4-chloro-2-methoxy-N~1~-{[5-(3-methoxyphenyl)-1H-pyrazol-4-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

M598-1589

Molecular Formula

C19H18ClN3O3 (C19 H18 ClN3 O3)

Compound Name

4-chloro-2-methoxy-N~1~-{[5-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}benzamide

IUPAC name

4-chloro-2-methoxy-N-{[5-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}benzamide

SMILES

COc1cccc(-c2c(CNC(c(ccc(Cl)c3)c3OC)=O)cn[nH]2)c1

InChI

InChI=1S/C19H18ClN3O3/c1-25-15-5-3-4-12(8-15)18-13(11-22-23-18)10-21-19(24)16-7-6-14(20)9-17(16)26-2/h3-9,11H,10H2,1-2H3,(H,21,24)(H,22,23)

InChI Key

ILFWPWDGKWIOKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27548755

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.82

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.346

Distribution Coefficient, logD

4.345

Water Solubility, LogSw

-4.69

Polar Surface Area

64.016

Acid Dissociation Constant (pKa)

10.08

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.79

M598-1589 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with M598-1589 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M598-1589?
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What is the minimum amount of M598-1589 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M598-1589
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M598-1589
  • 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 M598-1589 available by request