C651-0469 Screening compound: 1-[3-(2,3-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-4-(diphenylmethyl)piperazine

C651-0469 Screening compound: 1-[3-(2,3-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-4-(diphenylmethyl)piperazine
C651-0469 Screening compound: 1-[3-(2,3-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-4-(diphenylmethyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C651-0469
1-[3-(2,3-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-4-(diphenylmethyl)piperazine

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

C651-0469

Molecular Formula

C29H31N3O4 (C29 H31 N3 O4)

Compound Name

1-[3-(2,3-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]-4-(diphenylmethyl)piperazine

IUPAC name

1-[3-(23-dimethoxyphenyl)-45-dihydro-12-oxazole-5-carbonyl]-4-(diphenylmethyl)piperazine

SMILES

COc1cccc(C(C2)=NOC2C(N(CC2)CCN2C(c2ccccc2)c2ccccc2)=O)c1OC

InChI

InChI=1S/C29H31N3O4/c1-34-25-15-9-14-23(28(25)35-2)24-20-26(36-30-24)29(33)32-18-16-31(17-19-32)27(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-15,26-27H,16-20H2,1-2H3/t26-/m0/s1

InChI Key

HLUXBYMANNRPRS-SANMLTNESA-N

MDL Number (MFCD)

MFCD08106445

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.581

Distribution Coefficient, logD

4.577

Water Solubility, LogSw

-4.52

Polar Surface Area

57.389

Acid Dissociation Constant (pKa)

16.60

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.00

C651-0469 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C651-0469 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C651-0469?
Check Price and Availability of C651-0469, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C651-0469 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C651-0469
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C651-0469
  • 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 C651-0469 available by request