E948-0827 Screening compound: N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-6-methyl-4-(morpholin-4-yl)furo[2,3-d]pyrimidine-5-carboxamide

E948-0827 Screening compound: N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-6-methyl-4-(morpholin-4-yl)furo[2,3-d]pyrimidine-5-carboxamide
E948-0827 Screening compound: N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-6-methyl-4-(morpholin-4-yl)furo[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E948-0827
N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-6-methyl-4-(morpholin-4-yl)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

E948-0827

Molecular Formula

C25H30ClN5O3 (C25 H30 ClN5 O3)

Compound Name

N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-6-methyl-4-(morpholin-4-yl)furo[2,3-d]pyrimidine-5-carboxamide

IUPAC name

N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-6-methyl-4-(morpholin-4-yl)furo[23-d]pyrimidine-5-carboxamide

SMILES

Cc1c(C(NCC2CCN(Cc(cccc3)c3Cl)CC2)=O)c2c(N3CCOCC3)ncnc2o1

InChI

InChI=1S/C25H30ClN5O3/c1-17-21(22-23(28-16-29-25(22)34-17)31-10-12-33-13-11-31)24(32)27-14-18-6-8-30(9-7-18)15-19-4-2-3-5-20(19)26/h2-5,16,18H,6-15H2,1H3,(H,27,32)

InChI Key

WLSWOQISTGLYHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14930029

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.540

Distribution Coefficient, logD

1.903

Water Solubility, LogSw

-4.10

Polar Surface Area

67.609

Acid Dissociation Constant (pKa)

15.03

Base Dissociation Constant (pKb)

9.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

E948-0827 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with E948-0827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E948-0827?
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What is the minimum amount of E948-0827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E948-0827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E948-0827
  • 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 E948-0827 available by request