E948-0226 Screening compound: 1-[6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carbonyl]-2,3-dihydro-1H-indole

E948-0226 Screening compound: 1-[6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carbonyl]-2,3-dihydro-1H-indole
E948-0226 Screening compound: 1-[6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carbonyl]-2,3-dihydro-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound E948-0226
1-[6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carbonyl]-2,3-dihydro-1H-indole

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

E948-0226

Molecular Formula

C21H22N4O2 (C21 H22 N4 O2)

Compound Name

1-[6-methyl-4-(piperidin-1-yl)furo[2,3-d]pyrimidine-5-carbonyl]-2,3-dihydro-1H-indole

IUPAC name

1-[6-methyl-4-(piperidin-1-yl)furo[23-d]pyrimidine-5-carbonyl]-23-dihydro-1H-indole

SMILES

Cc1c(C(N(CC2)c3c2cccc3)=O)c2c(N3CCCCC3)ncnc2o1

InChI

InChI=1S/C21H22N4O2/c1-14-17(21(26)25-12-9-15-7-3-4-8-16(15)25)18-19(22-13-23-20(18)27-14)24-10-5-2-6-11-24/h3-4,7-8,13H,2,5-6,9-12H2,1H3

InChI Key

QIPXZINHUPARJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14929776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.850

Distribution Coefficient, logD

3.850

Water Solubility, LogSw

-4.24

Polar Surface Area

47.233

Acid Dissociation Constant (pKa)

21.95

Base Dissociation Constant (pKb)

0.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

E948-0226 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E948-0226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E948-0226?
Check Price and Availability of E948-0226, 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 E948-0226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E948-0226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E948-0226
  • 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 E948-0226 available by request