4369-0013 Screening compound: 2-(4-ethylphenyl)-2-oxoethyl 2-[(4-chlorophenyl)formamido]-3-(1H-indol-3-yl)propanoate

4369-0013 Screening compound: 2-(4-ethylphenyl)-2-oxoethyl 2-[(4-chlorophenyl)formamido]-3-(1H-indol-3-yl)propanoate
4369-0013 Screening compound: 2-(4-ethylphenyl)-2-oxoethyl 2-[(4-chlorophenyl)formamido]-3-(1H-indol-3-yl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4369-0013
2-(4-ethylphenyl)-2-oxoethyl 2-[(4-chlorophenyl)formamido]-3-(1H-indol-3-yl)propanoate

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

4369-0013

Molecular Formula

C28H25ClN2O4 (C28 H25 ClN2 O4)

Compound Name

2-(4-ethylphenyl)-2-oxoethyl 2-[(4-chlorophenyl)formamido]-3-(1H-indol-3-yl)propanoate

IUPAC name

2-(4-ethylphenyl)-2-oxoethyl 2-[(4-chlorophenyl)formamido]-3-(1H-indol-3-yl)propanoate

SMILES

CCc(cc1)ccc1C(COC(C(Cc1c[nH]c2c1cccc2)NC(c(cc1)ccc1Cl)=O)=O)=O

InChI

InChI=1S/C28H25ClN2O4/c1-2-18-7-9-19(10-8-18)26(32)17-35-28(34)25(31-27(33)20-11-13-22(29)14-12-20)15-21-16-30-24-6-4-3-5-23(21)24/h3-14,16,25,30H,2,15,17H2,1H3,(H,31,33)/t25-/m0/s1

InChI Key

MTXOTICSTXXEBD-VWLOTQADSA-N

MDL Number (MFCD)

MFCD06663583

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.97

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.438

Distribution Coefficient, logD

5.438

Water Solubility, LogSw

-6.07

Polar Surface Area

68.258

Acid Dissociation Constant (pKa)

10.72

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.90

References: we are preparing a list of scientific research reports with 4369-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4369-0013?
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What is the minimum amount of 4369-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4369-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4369-0013
  • 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 4369-0013 available by request