C198-0183 Screening compound: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea

C198-0183 Screening compound: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea
C198-0183 Screening compound: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C198-0183
3-[2-(2,5-dimethyl-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

C198-0183

Molecular Formula

C25H26N4S (C25 H26 N4 S)

Compound Name

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

IUPAC name

3-[2-(25-dimethyl-1H-indol-3-yl)ethyl]-1-phenyl-3-[(pyridin-4-yl)methyl]thiourea

SMILES

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

InChI

InChI=1S/C25H26N4S/c1-18-8-9-24-23(16-18)22(19(2)27-24)12-15-29(17-20-10-13-26-14-11-20)25(30)28-21-6-4-3-5-7-21/h3-11,13-14,16,27H,12,15,17H2,1-2H3,(H,28,30)

InChI Key

IQAUHCHSQYTMIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04460452

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.57

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

4.908

Distribution Coefficient, logD

4.889

Water Solubility, LogSw

-4.58

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

20.00

References: we are preparing a list of scientific research reports with C198-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C198-0183?
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What is the minimum amount of C198-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C198-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C198-0183
  • 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 C198-0183 available by request