C449-0151 Screening compound: 1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(2,4-dimethylphenyl)-1-[(pyridin-2-yl)methyl]thiourea

C449-0151 Screening compound: 1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(2,4-dimethylphenyl)-1-[(pyridin-2-yl)methyl]thiourea
C449-0151 Screening compound: 1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(2,4-dimethylphenyl)-1-[(pyridin-2-yl)methyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C449-0151
1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-(2,4-dimethylphenyl)-1-[(pyridin-2-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

C449-0151

Molecular Formula

C27H30N4S (C27 H30 N4 S)

Compound Name

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

IUPAC name

1-[2-(25-dimethyl-1H-indol-3-yl)ethyl]-3-(24-dimethylphenyl)-1-[(pyridin-2-yl)methyl]thiourea

SMILES

Cc1c(CCN(Cc2ncccc2)C(Nc2c(C)cc(C)cc2)=S)c(cc(C)cc2)c2[nH]1

InChI

InChI=1S/C27H30N4S/c1-18-8-10-25(20(3)15-18)30-27(32)31(17-22-7-5-6-13-28-22)14-12-23-21(4)29-26-11-9-19(2)16-24(23)26/h5-11,13,15-16,29H,12,14,17H2,1-4H3,(H,30,32)

InChI Key

OJLHSPYURMPGEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04466145

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.63

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

6.260

Distribution Coefficient, logD

6.260

Water Solubility, LogSw

-5.72

Polar Surface Area

29.178

Acid Dissociation Constant (pKa)

14.33

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with C449-0151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C449-0151?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C449-0151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C449-0151
  • 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 C449-0151 available by request