M709-0888 Screening compound: 2-{5H-chromeno[4,3-d]pyrimidin-2-ylsulfanyl}-N-ethyl-N-(3-methylphenyl)propanamide

M709-0888 Screening compound: 2-{5H-chromeno[4,3-d]pyrimidin-2-ylsulfanyl}-N-ethyl-N-(3-methylphenyl)propanamide
M709-0888 Screening compound: 2-{5H-chromeno[4,3-d]pyrimidin-2-ylsulfanyl}-N-ethyl-N-(3-methylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M709-0888
2-{5H-chromeno[4,3-d]pyrimidin-2-ylsulfanyl}-N-ethyl-N-(3-methylphenyl)propanamide

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

M709-0888

Molecular Formula

C23H23N3O2S (C23 H23 N3 O2 S)

Compound Name

2-{5H-chromeno[4,3-d]pyrimidin-2-ylsulfanyl}-N-ethyl-N-(3-methylphenyl)propanamide

IUPAC name

2-{5H-chromeno[43-d]pyrimidin-2-ylsulfanyl}-N-ethyl-N-(3-methylphenyl)propanamide

SMILES

CCN(C(C(C)Sc1nc(-c(cccc2)c2OC2)c2cn1)=O)c1cc(C)ccc1

InChI

InChI=1S/C23H23N3O2S/c1-4-26(18-9-7-8-15(2)12-18)22(27)16(3)29-23-24-13-17-14-28-20-11-6-5-10-19(20)21(17)25-23/h5-13,16H,4,14H2,1-3H3/t16-/m0/s1

InChI Key

KTZHAWRLJBATNZ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27551510

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.894

Distribution Coefficient, logD

4.894

Water Solubility, LogSw

-4.52

Polar Surface Area

42.360

Acid Dissociation Constant (pKa)

13.90

Base Dissociation Constant (pKb)

0.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

M709-0888 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M709-0888 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M709-0888?
Check Price and Availability of M709-0888, 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 M709-0888 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M709-0888
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M709-0888
  • 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 M709-0888 available by request