D142-0011 Screening compound: dimethyl (5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[(naphthalen-1-yl)methyl]-1,3-oxazol-4-yl)phosphonate

D142-0011 Screening compound: dimethyl (5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[(naphthalen-1-yl)methyl]-1,3-oxazol-4-yl)phosphonate
D142-0011 Screening compound: dimethyl (5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[(naphthalen-1-yl)methyl]-1,3-oxazol-4-yl)phosphonate alternative view

Chemical Structure Depiction of ChemDiv screening compound D142-0011
dimethyl (5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[(naphthalen-1-yl)methyl]-1,3-oxazol-4-yl)phosphonate

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

D142-0011

Molecular Formula

C25H27N2O5P (C25 H27 N2 O5 P)

Compound Name

dimethyl (5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[(naphthalen-1-yl)methyl]-1,3-oxazol-4-yl)phosphonate

IUPAC name

dimethyl (5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[(naphthalen-1-yl)methyl]-13-oxazol-4-yl)phosphonate

SMILES

COc1ccc(CCNc(oc(Cc2cccc3ccccc23)n2)c2P(OC)(OC)=O)cc1

InChI

InChI=1S/C25H27N2O5P/c1-29-21-13-11-18(12-14-21)15-16-26-24-25(33(28,30-2)31-3)27-23(32-24)17-20-9-6-8-19-7-4-5-10-22(19)20/h4-14,26H,15-17H2,1-3H3

InChI Key

KYWRUBYNWGTTBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07427616

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.894

Distribution Coefficient, logD

3.894

Water Solubility, LogSw

-4.06

Polar Surface Area

64.954

Acid Dissociation Constant (pKa)

16.77

Base Dissociation Constant (pKb)

-2.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

D142-0011 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D142-0011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D142-0011?
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What is the minimum amount of D142-0011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D142-0011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D142-0011
  • 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 D142-0011 available by request