K788-2433 Screening compound: 1-(3-chloro-4-fluorophenyl)-3-[(E)-({1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}methylidene)amino]thiourea

K788-2433 Screening compound: 1-(3-chloro-4-fluorophenyl)-3-[(E)-({1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}methylidene)amino]thiourea
K788-2433 Screening compound: 1-(3-chloro-4-fluorophenyl)-3-[(E)-({1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}methylidene)amino]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-2433
1-(3-chloro-4-fluorophenyl)-3-[(E)-({1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}methylidene)amino]thiourea

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

K788-2433

Molecular Formula

C19H15ClF2N4S (C19 H15 ClF2 N4 S)

Compound Name

1-(3-chloro-4-fluorophenyl)-3-[(E)-({1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}methylidene)amino]thiourea

IUPAC name

1-(3-chloro-4-fluorophenyl)-3-[(E)-({1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}methylidene)amino]thiourea

SMILES

Fc1c(Cn2c(/C=N/NC(Nc(cc3)cc(Cl)c3F)=S)ccc2)cccc1

InChI

InChI=1S/C19H15ClF2N4S/c20-16-10-14(7-8-18(16)22)24-19(27)25-23-11-15-5-3-9-26(15)12-13-4-1-2-6-17(13)21/h1-11H,12H2,(H2,24,25,27)

InChI Key

OEULFMZOGKBLAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15103836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.87

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.996

Distribution Coefficient, logD

5.996

Water Solubility, LogSw

-6.40

Polar Surface Area

33.356

Acid Dissociation Constant (pKa)

10.81

Base Dissociation Constant (pKb)

-0.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

References: we are preparing a list of scientific research reports with K788-2433 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-2433?
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What is the minimum amount of K788-2433 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-2433
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-2433
  • 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 K788-2433 available by request