P435-1050 Screening compound: methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}-2-phenylacetate

P435-1050 Screening compound: methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}-2-phenylacetate
P435-1050 Screening compound: methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}-2-phenylacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound P435-1050
methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}-2-phenylacetate

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

P435-1050

Molecular Formula

C22H28N4O5 (C22 H28 N4 O5)

Compound Name

methyl 2-{[(4-{4-[(dimethylamino)carbonyl]-5-methyl-1,3-oxazol-2-yl}piperidino)carbonyl]amino}-2-phenylacetate

IUPAC name

methyl 2-({4-[4-(dimethylcarbamoyl)-5-methyl-13-oxazol-2-yl]piperidine-1-carbonyl}amino)-2-phenylacetate

SMILES

Cc1c(C(N(C)C)=O)nc(C(CC2)CCN2C(NC(C(OC)=O)c2ccccc2)=O)o1

InChI

InChI=1S/C22H28N4O5/c1-14-17(20(27)25(2)3)23-19(31-14)16-10-12-26(13-11-16)22(29)24-18(21(28)30-4)15-8-6-5-7-9-15/h5-9,16,18H,10-13H2,1-4H3,(H,24,29)/t18-/m1/s1

InChI Key

UOGVNSCDUJPAQV-GOSISDBHSA-N

MDL Number (MFCD)

MFCD27575313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.365

Distribution Coefficient, logD

1.365

Water Solubility, LogSw

-1.65

Polar Surface Area

81.183

Acid Dissociation Constant (pKa)

13.17

Base Dissociation Constant (pKb)

-1.76

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.46

P435-1050 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P435-1050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P435-1050?
Check Price and Availability of P435-1050, 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 P435-1050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P435-1050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P435-1050
  • 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 P435-1050 available by request