P510-2056 Screening compound: 1-{6-[(4-methylphenyl)amino]pyrimidin-4-yl}-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide

Chemical Structure Depiction of ChemDiv screening compound P510-2056
1-{6-[(4-methylphenyl)amino]pyrimidin-4-yl}-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide

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)

Check Price and Availability

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

P510-2056

Molecular Formula

C₂₃H₂₆N₆O (C23 H26 N6 O)

Compound Name

1-{6-[(4-methylphenyl)amino]pyrimidin-4-yl}-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide

IUPAC name

1-{6-[(4-methylphenyl)amino]pyrimidin-4-yl}-N-[(pyridin-2-yl)methyl]piperidine-4-carboxamide

SMILES

Cc(cc1)ccc1Nc1cc(N(CC2)CCC2C(NCc2ncccc2)=O)ncn1

InChI

InChI=1S/C23H26N6O/c1-17-5-7-19(8-6-17)28-21-14-22(27-16-26-21)29-12-9-18(10-13-29)23(30)25-15-20-4-2-3-11-24-20/h2-8,11,14,16,18H,9-10,12-13,15H2,1H3,(H,25,30)(H,26,27,28)

InChI Key

BUHBVFLPBXYEEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27577929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

Partition Coefficient, logP

3.664

Distribution Coefficient, logD

3.610

Water Solubility, LogSw

-3.66

Polar Surface Area

66.400

Acid Dissociation Constant (pK_a)

12.37

Base Dissociation Constant (pK_b)

6.52

Number of Chiral Centers

0.00

Percent sp³ carbon bonding

30.40

P510-2056 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

CNS Targets (44014 compounds)

GPCR Targeted Library (31838 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PI3K-Targeted Library (17255 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:

Infections
Immune system
animal
Nervous system
Musculoskeletal
Respiratory tract
Nervous system
Congenital
Skin
Metabolic
Endocrine
Hemic and lymphatic
Cardiovascular
Cancer
Digestive system
Respiratory tract
Otorhinolaryngologic
Male
Female
Hemic and lymphatic
Skin
Infections
Cancer
Musculoskeletal
Digestive system
Respiratory tract
Male
Female
Cardiovascular
Skin
Metabolic
Immune system
Cancer
Digestive system
Female
Hemic and lymphatic
Metabolic
Immune system

Targets:

GPCR
Kinases
Proteases
Others

Mechanism of action:

Receptor's ligands
PPI modulators
PPI modulators

Structure:

Mimetics
Cyclic compounds

References: we are preparing a list of scientific research reports with P510-2056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P510-2056?
Check Price and Availability of P510-2056, 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 P510-2056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.

Delivery options for P510-2056
ChemDiv sends parcels with Express services (UPS, WC).

1–2 days for small orders
2–4 weeks for large selections

Delivery formats for P510-2056

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 P510-2056 available by request