C657-0123 Screening compound: 1-(2,6-diethylphenyl)-3-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]thiourea

C657-0123 Screening compound: 1-(2,6-diethylphenyl)-3-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]thiourea
C657-0123 Screening compound: 1-(2,6-diethylphenyl)-3-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C657-0123
1-(2,6-diethylphenyl)-3-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]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

C657-0123

Molecular Formula

C23H29N3S (C23 H29 N3 S)

Compound Name

1-(2,6-diethylphenyl)-3-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]thiourea

IUPAC name

1-(26-diethylphenyl)-3-[2-(25-dimethyl-1H-indol-3-yl)ethyl]thiourea

SMILES

CCc1cccc(CC)c1NC(NCCc1c(C)[nH]c2c1cc(C)cc2)=S

InChI

InChI=1S/C23H29N3S/c1-5-17-8-7-9-18(6-2)22(17)26-23(27)24-13-12-19-16(4)25-21-11-10-15(3)14-20(19)21/h7-11,14,25H,5-6,12-13H2,1-4H3,(H2,24,26,27)

InChI Key

OOZYYBPNDGVSDA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04471406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.57

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.539

Distribution Coefficient, logD

5.539

Water Solubility, LogSw

-5.66

Polar Surface Area

28.755

Acid Dissociation Constant (pKa)

14.81

Base Dissociation Constant (pKb)

0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with C657-0123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C657-0123?
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What is the minimum amount of C657-0123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C657-0123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C657-0123
  • 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 C657-0123 available by request