D647-0102 Screening compound: N-[2-(3,4-dimethoxyphenyl)-2-(piperidin-1-yl)ethyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide

D647-0102 Screening compound: N-[2-(3,4-dimethoxyphenyl)-2-(piperidin-1-yl)ethyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
D647-0102 Screening compound: N-[2-(3,4-dimethoxyphenyl)-2-(piperidin-1-yl)ethyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D647-0102
N-[2-(3,4-dimethoxyphenyl)-2-(piperidin-1-yl)ethyl]-5-(4-methoxyphenyl)-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

D647-0102

Molecular Formula

C26H31N3O5 (C26 H31 N3 O5)

Compound Name

N-[2-(3,4-dimethoxyphenyl)-2-(piperidin-1-yl)ethyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)-2-(piperidin-1-yl)ethyl]-5-(4-methoxyphenyl)-12-oxazole-3-carboxamide

SMILES

COc(cc1)ccc1-c1cc(C(NCC(c(cc2)cc(OC)c2OC)N2CCCCC2)=O)no1

InChI

InChI=1S/C26H31N3O5/c1-31-20-10-7-18(8-11-20)24-16-21(28-34-24)26(30)27-17-22(29-13-5-4-6-14-29)19-9-12-23(32-2)25(15-19)33-3/h7-12,15-16,22H,4-6,13-14,17H2,1-3H3,(H,27,30)/t22-/m0/s1

InChI Key

WMTMTMBHWGBEPX-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD18078990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.934

Distribution Coefficient, logD

2.566

Water Solubility, LogSw

-4.03

Polar Surface Area

71.981

Acid Dissociation Constant (pKa)

13.09

Base Dissociation Constant (pKb)

8.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with D647-0102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D647-0102?
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What is the minimum amount of D647-0102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D647-0102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D647-0102
  • 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 D647-0102 available by request