ZC47-0206 Screening compound: 3-{2-[({4-[1-(cyclopropylcarbonyl)-4-piperidyl]-2-methyl-5-pyrimidinyl}carbonyl)amino]ethyl}benzoic acid

ZC47-0206 Screening compound: 3-{2-[({4-[1-(cyclopropylcarbonyl)-4-piperidyl]-2-methyl-5-pyrimidinyl}carbonyl)amino]ethyl}benzoic acid
ZC47-0206 Screening compound: 3-{2-[({4-[1-(cyclopropylcarbonyl)-4-piperidyl]-2-methyl-5-pyrimidinyl}carbonyl)amino]ethyl}benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound ZC47-0206
3-{2-[({4-[1-(cyclopropylcarbonyl)-4-piperidyl]-2-methyl-5-pyrimidinyl}carbonyl)amino]ethyl}benzoic acid

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

ZC47-0206

Molecular Formula

C24H28N4O4 (C24 H28 N4 O4)

Compound Name

3-{2-[({4-[1-(cyclopropylcarbonyl)-4-piperidyl]-2-methyl-5-pyrimidinyl}carbonyl)amino]ethyl}benzoic acid

IUPAC name

3-(2-{[4-(1-cyclopropanecarbonylpiperidin-4-yl)-2-methylpyrimidin-5-yl]formamido}ethyl)benzoic acid

SMILES

Cc(nc1)nc(C(CC2)CCN2C(C2CC2)=O)c1C(NCCc1cccc(C(O)=O)c1)=O

InChI

InChI=1S/C24H28N4O4/c1-15-26-14-20(22(29)25-10-7-16-3-2-4-19(13-16)24(31)32)21(27-15)17-8-11-28(12-9-17)23(30)18-5-6-18/h2-4,13-14,17-18H,5-12H2,1H3,(H,25,29)(H,31,32)

InChI Key

VNQOSHTZWAZZQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31958511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.470

Distribution Coefficient, logD

-0.427

Water Solubility, LogSw

-2.60

Polar Surface Area

89.278

Acid Dissociation Constant (pKa)

4.50

Base Dissociation Constant (pKb)

2.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.83

ZC47-0206 in Drug Discovery

Included in Screening Libraries

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

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with ZC47-0206 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound ZC47-0206?
Check Price and Availability of ZC47-0206, 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 ZC47-0206 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for ZC47-0206
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for ZC47-0206
  • 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 ZC47-0206 available by request