C351-0162 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}-4-ethyl-4,5-dihydro-1,3-oxazole

C351-0162 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}-4-ethyl-4,5-dihydro-1,3-oxazole
C351-0162 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}-4-ethyl-4,5-dihydro-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C351-0162
2-{1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}-4-ethyl-4,5-dihydro-1,3-oxazole

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

C351-0162

Molecular Formula

C16H17ClN2O (C16 H17 ClN2 O)

Compound Name

2-{1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}-4-ethyl-4,5-dihydro-1,3-oxazole

IUPAC name

2-{1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}-4-ethyl-45-dihydro-13-oxazole

SMILES

CCC1N=C(c2cccn2Cc(cccc2)c2Cl)OC1

InChI

InChI=1S/C16H17ClN2O/c1-2-13-11-20-16(18-13)15-8-5-9-19(15)10-12-6-3-4-7-14(12)17/h3-9,13H,2,10-11H2,1H3/t13-/m1/s1

InChI Key

KYPNRXKJDXVYGL-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD14750796

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.78

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.249

Distribution Coefficient, logD

4.249

Water Solubility, LogSw

-4.36

Polar Surface Area

20.521

Acid Dissociation Constant (pKa)

26.81

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.30

C351-0162 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C351-0162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C351-0162?
Check Price and Availability of C351-0162, 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 C351-0162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C351-0162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C351-0162
  • 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 C351-0162 available by request