T829-0848 Screening compound: methyl 3-({2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridin-3-yl}formamido)propanoate

T829-0848 Screening compound: methyl 3-({2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridin-3-yl}formamido)propanoate
T829-0848 Screening compound: methyl 3-({2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridin-3-yl}formamido)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound T829-0848
methyl 3-({2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridin-3-yl}formamido)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

T829-0848

Molecular Formula

C21H26N2O4 (C21 H26 N2 O4)

Compound Name

methyl 3-({2-methyl-5-[(4-methylphenyl)methyl]-4H,5H,6H,7H-furo[3,2-c]pyridin-3-yl}formamido)propanoate

IUPAC name

methyl 3-({2-methyl-5-[(4-methylphenyl)methyl]-4H5H6H7H-furo[32-c]pyridin-3-yl}formamido)propanoate

SMILES

Cc1c(C(NCCC(OC)=O)=O)c(CN(Cc2ccc(C)cc2)CC2)c2o1

InChI

InChI=1S/C21H26N2O4/c1-14-4-6-16(7-5-14)12-23-11-9-18-17(13-23)20(15(2)27-18)21(25)22-10-8-19(24)26-3/h4-7H,8-13H2,1-3H3,(H,22,25)

InChI Key

ZGWPYVKIXUSHGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28993500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.081

Distribution Coefficient, logD

-2.479

Water Solubility, LogSw

-2.71

Polar Surface Area

56.966

Acid Dissociation Constant (pKa)

13.48

Base Dissociation Constant (pKb)

11.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

T829-0848 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Integrin Receptors Targeted library (1715 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with T829-0848 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T829-0848?
Check Price and Availability of T829-0848, 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 T829-0848 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T829-0848
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T829-0848
  • 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 T829-0848 available by request