E948-0678 Screening compound: 6-methyl-4-(morpholin-4-yl)-N-[4-(piperidine-1-sulfonyl)phenyl]furo[2,3-d]pyrimidine-5-carboxamide

E948-0678 Screening compound: 6-methyl-4-(morpholin-4-yl)-N-[4-(piperidine-1-sulfonyl)phenyl]furo[2,3-d]pyrimidine-5-carboxamide
E948-0678 Screening compound: 6-methyl-4-(morpholin-4-yl)-N-[4-(piperidine-1-sulfonyl)phenyl]furo[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E948-0678
6-methyl-4-(morpholin-4-yl)-N-[4-(piperidine-1-sulfonyl)phenyl]furo[2,3-d]pyrimidine-5-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

E948-0678

Molecular Formula

C23H27N5O5S (C23 H27 N5 O5 S)

Compound Name

6-methyl-4-(morpholin-4-yl)-N-[4-(piperidine-1-sulfonyl)phenyl]furo[2,3-d]pyrimidine-5-carboxamide

IUPAC name

6-methyl-4-(morpholin-4-yl)-N-[4-(piperidine-1-sulfonyl)phenyl]furo[23-d]pyrimidine-5-carboxamide

SMILES

Cc1c(C(Nc(cc2)ccc2S(N2CCCCC2)(=O)=O)=O)c2c(N3CCOCC3)ncnc2o1

InChI

InChI=1S/C23H27N5O5S/c1-16-19(20-21(24-15-25-23(20)33-16)27-11-13-32-14-12-27)22(29)26-17-5-7-18(8-6-17)34(30,31)28-9-3-2-4-10-28/h5-8,15H,2-4,9-14H2,1H3,(H,26,29)

InChI Key

TTWBBCGEAFZXDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14929987

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.56

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.837

Distribution Coefficient, logD

2.837

Water Solubility, LogSw

-3.64

Polar Surface Area

94.265

Acid Dissociation Constant (pKa)

10.52

Base Dissociation Constant (pKb)

0.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

E948-0678 in Drug Discovery

Included in Screening Libraries

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

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with E948-0678 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E948-0678?
Check Price and Availability of E948-0678, 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 E948-0678 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E948-0678
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E948-0678
  • 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 E948-0678 available by request