C753-1345 Screening compound: 1-[(4-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid

C753-1345 Screening compound: 1-[(4-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
C753-1345 Screening compound: 1-[(4-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C753-1345
1-[(4-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid

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

C753-1345

Molecular Formula

C24H24N2O2S (C24 H24 N2 O2 S)

Compound Name

1-[(4-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid

IUPAC name

1-[(4-methylphenyl)methyl]-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid

SMILES

Cc1ccc(Cn2c(C(O)=O)c(CNCCc3cccs3)c3c2cccc3)cc1

InChI

InChI=1S/C24H24N2O2S/c1-17-8-10-18(11-9-17)16-26-22-7-3-2-6-20(22)21(23(26)24(27)28)15-25-13-12-19-5-4-14-29-19/h2-11,14,25H,12-13,15-16H2,1H3,(H,27,28)

InChI Key

UMBCVCCSDWRJMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26966026

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.405

Distribution Coefficient, logD

4.405

Water Solubility, LogSw

-4.08

Polar Surface Area

41.502

Acid Dissociation Constant (pKa)

4.47

Base Dissociation Constant (pKb)

10.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

C753-1345 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with C753-1345 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C753-1345?
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What is the minimum amount of C753-1345 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C753-1345
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C753-1345
  • 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 C753-1345 available by request