C289-0355 Screening compound: 5-chloro-3-[({3-[ethyl(phenyl)amino]propyl}carbamoyl)methyl]-1H-indole-2-carboxylic acid

C289-0355 Screening compound: 5-chloro-3-[({3-[ethyl(phenyl)amino]propyl}carbamoyl)methyl]-1H-indole-2-carboxylic acid
C289-0355 Screening compound: 5-chloro-3-[({3-[ethyl(phenyl)amino]propyl}carbamoyl)methyl]-1H-indole-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C289-0355
5-chloro-3-[({3-[ethyl(phenyl)amino]propyl}carbamoyl)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

C289-0355

Molecular Formula

C22H24ClN3O3 (C22 H24 ClN3 O3)

Compound Name

5-chloro-3-[({3-[ethyl(phenyl)amino]propyl}carbamoyl)methyl]-1H-indole-2-carboxylic acid

IUPAC name

5-chloro-3-[({3-[ethyl(phenyl)amino]propyl}carbamoyl)methyl]-1H-indole-2-carboxylic acid

SMILES

CCN(CCCNC(Cc1c(C(O)=O)[nH]c(cc2)c1cc2Cl)=O)c1ccccc1

InChI

InChI=1S/C22H24ClN3O3/c1-2-26(16-7-4-3-5-8-16)12-6-11-24-20(27)14-18-17-13-15(23)9-10-19(17)25-21(18)22(28)29/h3-5,7-10,13,25H,2,6,11-12,14H2,1H3,(H,24,27)(H,28,29)

InChI Key

ZGWIPGHEDMMTGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14741121

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.294

Distribution Coefficient, logD

0.740

Water Solubility, LogSw

-3.54

Polar Surface Area

65.797

Acid Dissociation Constant (pKa)

4.85

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

C289-0355 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 C289-0355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C289-0355?
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What is the minimum amount of C289-0355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C289-0355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C289-0355
  • 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 C289-0355 available by request