E847-0344 Screening compound: 3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid

E847-0344 Screening compound: 3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid
E847-0344 Screening compound: 3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound E847-0344
3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-6-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

E847-0344

Molecular Formula

C28H30N2O5 (C28 H30 N2 O5)

Compound Name

3-({[(2,5-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid

IUPAC name

3-({[(25-dimethoxyphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-6-methyl-1H-indole-2-carboxylic acid

SMILES

Cc(cc1)cc2c1c(CNCc(cc(cc1)OC)c1OC)c(C(O)=O)n2Cc(cc1)ccc1OC

InChI

InChI=1S/C28H30N2O5/c1-18-5-11-23-24(16-29-15-20-14-22(34-3)10-12-26(20)35-4)27(28(31)32)30(25(23)13-18)17-19-6-8-21(33-2)9-7-19/h5-14,29H,15-17H2,1-4H3,(H,31,32)

InChI Key

WVQMVEKFRZKPLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27602066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.852

Distribution Coefficient, logD

4.852

Water Solubility, LogSw

-4.61

Polar Surface Area

63.360

Acid Dissociation Constant (pKa)

4.47

Base Dissociation Constant (pKb)

12.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with E847-0344 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E847-0344?
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What is the minimum amount of E847-0344 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E847-0344
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E847-0344
  • 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 E847-0344 available by request