3793-2097 Screening compound: 3-chloro-4-[(5-chloro-2-methoxyphenyl)amino]-1-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1H-pyrrole-2,5-dione

3793-2097 Screening compound: 3-chloro-4-[(5-chloro-2-methoxyphenyl)amino]-1-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1H-pyrrole-2,5-dione
3793-2097 Screening compound: 3-chloro-4-[(5-chloro-2-methoxyphenyl)amino]-1-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1H-pyrrole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3793-2097
3-chloro-4-[(5-chloro-2-methoxyphenyl)amino]-1-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1H-pyrrole-2,5-dione

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

3793-2097

Molecular Formula

C18H11Cl2F3N2O3 (C18 H11 Cl2 F3 N2 O3)

Compound Name

3-chloro-4-[(5-chloro-2-methoxyphenyl)amino]-1-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1H-pyrrole-2,5-dione

IUPAC name

3-chloro-4-[(5-chloro-2-methoxyphenyl)amino]-1-[3-(trifluoromethyl)phenyl]-25-dihydro-1H-pyrrole-25-dione

SMILES

COc(ccc(Cl)c1)c1NC(C(N(C1=O)c2cc(C(F)(F)F)ccc2)=O)=C1Cl

InChI

InChI=1S/C18H11Cl2F3N2O3/c1-28-13-6-5-10(19)8-12(13)24-15-14(20)16(26)25(17(15)27)11-4-2-3-9(7-11)18(21,22)23/h2-8,24H,1H3

InChI Key

LLULJZCCRVPNEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02355141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.2

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.351

Distribution Coefficient, logD

3.072

Water Solubility, LogSw

-4.70

Polar Surface Area

45.195

Acid Dissociation Constant (pKa)

6.14

Base Dissociation Constant (pKb)

-0.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

3793-2097 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 3793-2097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3793-2097?
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What is the minimum amount of 3793-2097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3793-2097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3793-2097
  • 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 3793-2097 available by request