C197-0529 Screening compound: 3-({[4-(propan-2-yl)phenyl](propyl)carbamoyl}methyl)-1H-indole-2-carboxylic acid

C197-0529 Screening compound: 3-({[4-(propan-2-yl)phenyl](propyl)carbamoyl}methyl)-1H-indole-2-carboxylic acid
C197-0529 Screening compound: 3-({[4-(propan-2-yl)phenyl](propyl)carbamoyl}methyl)-1H-indole-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C197-0529
3-({[4-(propan-2-yl)phenyl](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

C197-0529

Molecular Formula

C23H26N2O3 (C23 H26 N2 O3)

Compound Name

3-({[4-(propan-2-yl)phenyl](propyl)carbamoyl}methyl)-1H-indole-2-carboxylic acid

IUPAC name

3-({[4-(propan-2-yl)phenyl](propyl)carbamoyl}methyl)-1H-indole-2-carboxylic acid

SMILES

CCCN(C(Cc1c(C(O)=O)[nH]c2c1cccc2)=O)c1ccc(C(C)C)cc1

InChI

InChI=1S/C23H26N2O3/c1-4-13-25(17-11-9-16(10-12-17)15(2)3)21(26)14-19-18-7-5-6-8-20(18)24-22(19)23(27)28/h5-12,15,24H,4,13-14H2,1-3H3,(H,27,28)

InChI Key

YNVKZNYYYPIALV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14725398

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.790

Distribution Coefficient, logD

2.236

Water Solubility, LogSw

-4.39

Polar Surface Area

53.840

Acid Dissociation Constant (pKa)

4.85

Base Dissociation Constant (pKb)

-1.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with C197-0529 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C197-0529?
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What is the minimum amount of C197-0529 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C197-0529
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C197-0529
  • 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 C197-0529 available by request