C892-0155 Screening compound: methyl 1-[(2-chlorophenyl)methyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate

C892-0155 Screening compound: methyl 1-[(2-chlorophenyl)methyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate
C892-0155 Screening compound: methyl 1-[(2-chlorophenyl)methyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C892-0155
methyl 1-[(2-chlorophenyl)methyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate

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

C892-0155

Molecular Formula

C17H14ClNO3 (C17 H14 ClNO3)

Compound Name

methyl 1-[(2-chlorophenyl)methyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate

IUPAC name

methyl 1-[(2-chlorophenyl)methyl]-5-(furan-2-yl)-1H-pyrrole-2-carboxylate

SMILES

COC(c1ccc(-c2ccco2)n1Cc(cccc1)c1Cl)=O

InChI

InChI=1S/C17H14ClNO3/c1-21-17(20)15-9-8-14(16-7-4-10-22-16)19(15)11-12-5-2-3-6-13(12)18/h2-10H,11H2,1H3

InChI Key

DTRVSLRPKFTSQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14807086

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.76

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.265

Distribution Coefficient, logD

4.265

Water Solubility, LogSw

-4.30

Polar Surface Area

29.923

Acid Dissociation Constant (pKa)

25.91

Base Dissociation Constant (pKb)

-4.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

C892-0155 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 C892-0155 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C892-0155?
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What is the minimum amount of C892-0155 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C892-0155
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C892-0155
  • 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 C892-0155 available by request