Y040-9787 Screening compound: 5-methoxy-N-[3-(3-methoxyanilino)-3-oxopropyl]-1-methyl-1H-indole-2-carboxamide

Y040-9787 Screening compound: 5-methoxy-N-[3-(3-methoxyanilino)-3-oxopropyl]-1-methyl-1H-indole-2-carboxamide
Y040-9787 Screening compound: 5-methoxy-N-[3-(3-methoxyanilino)-3-oxopropyl]-1-methyl-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-9787
5-methoxy-N-[3-(3-methoxyanilino)-3-oxopropyl]-1-methyl-1H-indole-2-carboxamide

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

Y040-9787

Molecular Formula

C21H23N3O4 (C21 H23 N3 O4)

Compound Name

5-methoxy-N-[3-(3-methoxyanilino)-3-oxopropyl]-1-methyl-1H-indole-2-carboxamide

IUPAC name

3-[(5-methoxy-1-methyl-1H-indol-2-yl)formamido]-N-(3-methoxyphenyl)propanamide

SMILES

Cn(c(C(NCCC(Nc1cc(OC)ccc1)=O)=O)c1)c(cc2)c1cc2OC

InChI

InChI=1S/C21H23N3O4/c1-24-18-8-7-17(28-3)11-14(18)12-19(24)21(26)22-10-9-20(25)23-15-5-4-6-16(13-15)27-2/h4-8,11-13H,9-10H2,1-3H3,(H,22,26)(H,23,25)

InChI Key

IBEJYGTXCAKDSD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.769

Distribution Coefficient, logD

2.769

Water Solubility, LogSw

-3.35

Polar Surface Area

64.266

Acid Dissociation Constant (pKa)

11.47

Base Dissociation Constant (pKb)

1.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.81

References: we are preparing a list of scientific research reports with Y040-9787 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-9787?
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What is the minimum amount of Y040-9787 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-9787
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-9787
  • 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 Y040-9787 available by request