P212-0557 Screening compound: N-(2-phenylpyrimidin-5-yl)-2-(thiophen-3-yl)acetamide

P212-0557 Screening compound: N-(2-phenylpyrimidin-5-yl)-2-(thiophen-3-yl)acetamide
P212-0557 Screening compound: N-(2-phenylpyrimidin-5-yl)-2-(thiophen-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P212-0557
N-(2-phenylpyrimidin-5-yl)-2-(thiophen-3-yl)acetamide

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

P212-0557

Molecular Formula

C16H13N3OS (C16 H13 N3 OS)

Compound Name

N-(2-phenylpyrimidin-5-yl)-2-(thiophen-3-yl)acetamide

IUPAC name

N-(2-phenylpyrimidin-5-yl)-2-(thiophen-3-yl)acetamide

SMILES

O=C(Cc1cscc1)Nc1cnc(-c2ccccc2)nc1

InChI

InChI=1S/C16H13N3OS/c20-15(8-12-6-7-21-11-12)19-14-9-17-16(18-10-14)13-4-2-1-3-5-13/h1-7,9-11H,8H2,(H,19,20)

InChI Key

DREBFPJWZHBBMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29020734

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.079

Distribution Coefficient, logD

3.079

Water Solubility, LogSw

-3.21

Polar Surface Area

43.478

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

1.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

P212-0557 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P212-0557 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P212-0557?
Check Price and Availability of P212-0557, 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 P212-0557 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P212-0557
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P212-0557
  • 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 P212-0557 available by request