M475-0049 Screening compound: N-(3-chloro-2-methylphenyl)-2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carboxamide

M475-0049 Screening compound: N-(3-chloro-2-methylphenyl)-2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carboxamide
M475-0049 Screening compound: N-(3-chloro-2-methylphenyl)-2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M475-0049
N-(3-chloro-2-methylphenyl)-2-phenyl-4-(pyridin-4-yl)pyrimidine-5-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)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

M475-0049

Molecular Formula

C23H17ClN4O (C23 H17 ClN4 O)

Compound Name

N-(3-chloro-2-methylphenyl)-2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carboxamide

IUPAC name

N-(3-chloro-2-methylphenyl)-2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carboxamide

SMILES

Cc(c(NC(c1c(-c2ccncc2)nc(-c2ccccc2)nc1)=O)ccc1)c1Cl

InChI

InChI=1S/C23H17ClN4O/c1-15-19(24)8-5-9-20(15)27-23(29)18-14-26-22(17-6-3-2-4-7-17)28-21(18)16-10-12-25-13-11-16/h2-14H,1H3,(H,27,29)

InChI Key

RHECSKRTUXOSBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27543969

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.768

Distribution Coefficient, logD

4.765

Water Solubility, LogSw

-4.83

Polar Surface Area

51.380

Acid Dissociation Constant (pKa)

9.51

Base Dissociation Constant (pKb)

4.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

M475-0049 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with M475-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M475-0049?
Check Price and Availability of M475-0049, 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 M475-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M475-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M475-0049
  • 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 M475-0049 available by request