G396-1223 Screening compound: 4-({[(4-ethylphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid

G396-1223 Screening compound: 4-({[(4-ethylphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
G396-1223 Screening compound: 4-({[(4-ethylphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound G396-1223
4-({[(4-ethylphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-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

G396-1223

Molecular Formula

C25H30N2O3 (C25 H30 N2 O3)

Compound Name

4-({[(4-ethylphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid

IUPAC name

4-({[(4-ethylphenyl)methyl]amino}methyl)-1-[(4-methoxyphenyl)methyl]-25-dimethyl-1H-pyrrole-3-carboxylic acid

SMILES

CCc1ccc(CNCc2c(C)n(Cc(cc3)ccc3OC)c(C)c2C(O)=O)cc1

InChI

InChI=1S/C25H30N2O3/c1-5-19-6-8-20(9-7-19)14-26-15-23-17(2)27(18(3)24(23)25(28)29)16-21-10-12-22(30-4)13-11-21/h6-13,26H,5,14-16H2,1-4H3,(H,28,29)

InChI Key

SLBPDBNOLCKUBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15008598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.526

Distribution Coefficient, logD

4.526

Water Solubility, LogSw

-4.30

Polar Surface Area

49.654

Acid Dissociation Constant (pKa)

6.39

Base Dissociation Constant (pKb)

13.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with G396-1223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G396-1223?
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What is the minimum amount of G396-1223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G396-1223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G396-1223
  • 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 G396-1223 available by request