D647-0127 Screening compound: 5-(4-ethoxyphenyl)-N-[2-phenyl-2-(pyrrolidin-1-yl)ethyl]-1,2-oxazole-3-carboxamide

D647-0127 Screening compound: 5-(4-ethoxyphenyl)-N-[2-phenyl-2-(pyrrolidin-1-yl)ethyl]-1,2-oxazole-3-carboxamide
D647-0127 Screening compound: 5-(4-ethoxyphenyl)-N-[2-phenyl-2-(pyrrolidin-1-yl)ethyl]-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D647-0127
5-(4-ethoxyphenyl)-N-[2-phenyl-2-(pyrrolidin-1-yl)ethyl]-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

D647-0127

Molecular Formula

C24H27N3O3 (C24 H27 N3 O3)

Compound Name

5-(4-ethoxyphenyl)-N-[2-phenyl-2-(pyrrolidin-1-yl)ethyl]-1,2-oxazole-3-carboxamide

IUPAC name

5-(4-ethoxyphenyl)-N-[2-phenyl-2-(pyrrolidin-1-yl)ethyl]-12-oxazole-3-carboxamide

SMILES

CCOc(cc1)ccc1-c1cc(C(NCC(c2ccccc2)N2CCCC2)=O)no1

InChI

InChI=1S/C24H27N3O3/c1-2-29-20-12-10-19(11-13-20)23-16-21(26-30-23)24(28)25-17-22(27-14-6-7-15-27)18-8-4-3-5-9-18/h3-5,8-13,16,22H,2,6-7,14-15,17H2,1H3,(H,25,28)/t22-/m0/s1

InChI Key

AXMQPJLIUGPHQV-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD18078874

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.219

Distribution Coefficient, logD

3.521

Water Solubility, LogSw

-4.03

Polar Surface Area

56.666

Acid Dissociation Constant (pKa)

13.09

Base Dissociation Constant (pKb)

8.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with D647-0127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D647-0127?
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What is the minimum amount of D647-0127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D647-0127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D647-0127
  • 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 D647-0127 available by request