C198-0279 Screening compound: 3-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea

C198-0279 Screening compound: 3-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea
C198-0279 Screening compound: 3-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C198-0279
3-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]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

C198-0279

Molecular Formula

C24H23FN4S (C24 H23 FN4 S)

Compound Name

3-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea

IUPAC name

3-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea

SMILES

Cc1c(CCN(Cc2ccncc2)C(Nc2ccccc2)=S)c(cc(cc2)F)c2[nH]1

InChI

InChI=1S/C24H23FN4S/c1-17-21(22-15-19(25)7-8-23(22)27-17)11-14-29(16-18-9-12-26-13-10-18)24(30)28-20-5-3-2-4-6-20/h2-10,12-13,15,27H,11,14,16H2,1H3,(H,28,30)

InChI Key

WMQJWVGNEVETKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04460518

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.54

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.518

Distribution Coefficient, logD

4.500

Water Solubility, LogSw

-4.21

Polar Surface Area

29.760

Acid Dissociation Constant (pKa)

14.84

Base Dissociation Constant (pKb)

6.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with C198-0279 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C198-0279?
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What is the minimum amount of C198-0279 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C198-0279
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C198-0279
  • 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 C198-0279 available by request