E948-1611 Screening compound: N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-2,6-dimethyl-4-(morpholin-4-yl)furo[2,3-d]pyrimidine-5-carboxamide

E948-1611 Screening compound: N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-2,6-dimethyl-4-(morpholin-4-yl)furo[2,3-d]pyrimidine-5-carboxamide
E948-1611 Screening compound: N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-2,6-dimethyl-4-(morpholin-4-yl)furo[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E948-1611
N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-2,6-dimethyl-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

E948-1611

Molecular Formula

C26H32ClN5O3 (C26 H32 ClN5 O3)

Compound Name

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

IUPAC name

N-({1-[(2-chlorophenyl)methyl]piperidin-4-yl}methyl)-26-dimethyl-4-(morpholin-4-yl)furo[23-d]pyrimidine-5-carboxamide

SMILES

Cc1c(C(NCC2CCN(Cc(cccc3)c3Cl)CC2)=O)c2c(N3CCOCC3)nc(C)nc2o1

InChI

InChI=1S/C26H32ClN5O3/c1-17-22(23-24(32-11-13-34-14-12-32)29-18(2)30-26(23)35-17)25(33)28-15-19-7-9-31(10-8-19)16-20-5-3-4-6-21(20)27/h3-6,19H,7-16H2,1-2H3,(H,28,33)

InChI Key

SUDOANUOMPHHQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14930164

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.02

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

3.762

Distribution Coefficient, logD

2.125

Water Solubility, LogSw

-4.37

Polar Surface Area

65.983

Acid Dissociation Constant (pKa)

15.03

Base Dissociation Constant (pKb)

9.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

E948-1611 in Drug Discovery

Included in Screening Libraries

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

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 E948-1611 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E948-1611?
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What is the minimum amount of E948-1611 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E948-1611
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E948-1611
  • 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 E948-1611 available by request