D647-0156 Screening compound: N-[2-(4-tert-butylphenyl)-2-(morpholin-4-yl)ethyl]-5-(4-chlorophenyl)-1,2-oxazole-3-carboxamide

D647-0156 Screening compound: N-[2-(4-tert-butylphenyl)-2-(morpholin-4-yl)ethyl]-5-(4-chlorophenyl)-1,2-oxazole-3-carboxamide
D647-0156 Screening compound: N-[2-(4-tert-butylphenyl)-2-(morpholin-4-yl)ethyl]-5-(4-chlorophenyl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D647-0156
N-[2-(4-tert-butylphenyl)-2-(morpholin-4-yl)ethyl]-5-(4-chlorophenyl)-1,2-oxazole-3-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

D647-0156

Molecular Formula

C26H30ClN3O3 (C26 H30 ClN3 O3)

Compound Name

N-[2-(4-tert-butylphenyl)-2-(morpholin-4-yl)ethyl]-5-(4-chlorophenyl)-1,2-oxazole-3-carboxamide

IUPAC name

N-[2-(4-tert-butylphenyl)-2-(morpholin-4-yl)ethyl]-5-(4-chlorophenyl)-12-oxazole-3-carboxamide

SMILES

CC(C)(C)c1ccc(C(CNC(c2noc(-c(cc3)ccc3Cl)c2)=O)N2CCOCC2)cc1

InChI

InChI=1S/C26H30ClN3O3/c1-26(2,3)20-8-4-18(5-9-20)23(30-12-14-32-15-13-30)17-28-25(31)22-16-24(33-29-22)19-6-10-21(27)11-7-19/h4-11,16,23H,12-15,17H2,1-3H3,(H,28,31)/t23-/m0/s1

InChI Key

NLPYXEIFUFWLGB-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD18078648

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.678

Distribution Coefficient, logD

5.670

Water Solubility, LogSw

-6.16

Polar Surface Area

57.085

Acid Dissociation Constant (pKa)

13.09

Base Dissociation Constant (pKb)

5.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

D647-0156 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with D647-0156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D647-0156?
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What is the minimum amount of D647-0156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D647-0156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D647-0156
  • 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 D647-0156 available by request