M046-1357 Screening compound: 2-({1-[(4-methoxyphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide

M046-1357 Screening compound: 2-({1-[(4-methoxyphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide
M046-1357 Screening compound: 2-({1-[(4-methoxyphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M046-1357
2-({1-[(4-methoxyphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide

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

M046-1357

Molecular Formula

C26H27N3O5S (C26 H27 N3 O5 S)

Compound Name

2-({1-[(4-methoxyphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide

IUPAC name

2-({1-[(4-methoxyphenyl)methyl]-1H-pyrrolo[32-c]pyridin-4-yl}sulfanyl)-N-(345-trimethoxyphenyl)acetamide

SMILES

COc1ccc(Cn(cc2)c3c2c(SCC(Nc(cc2OC)cc(OC)c2OC)=O)ncc3)cc1

InChI

InChI=1S/C26H27N3O5S/c1-31-19-7-5-17(6-8-19)15-29-12-10-20-21(29)9-11-27-26(20)35-16-24(30)28-18-13-22(32-2)25(34-4)23(14-18)33-3/h5-14H,15-16H2,1-4H3,(H,28,30)

InChI Key

XNSRXGDVSVJWQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15139430

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.681

Distribution Coefficient, logD

3.680

Water Solubility, LogSw

-4.05

Polar Surface Area

64.656

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

4.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

M046-1357 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with M046-1357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M046-1357?
Check Price and Availability of M046-1357, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M046-1357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M046-1357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M046-1357
  • 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 M046-1357 available by request