D576-0218 Screening compound: N-(4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)naphthalene-1-carboxamide

D576-0218 Screening compound: N-(4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)naphthalene-1-carboxamide
D576-0218 Screening compound: N-(4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)naphthalene-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D576-0218
N-(4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)naphthalene-1-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

D576-0218

Molecular Formula

C26H25N5O2 (C26 H25 N5 O2)

Compound Name

N-(4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)naphthalene-1-carboxamide

IUPAC name

N-(4-{[6-methyl-2-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)naphthalene-1-carboxamide

SMILES

Cc1cc(Nc(cc2)ccc2NC(c2cccc3ccccc23)=O)nc(N2CCOCC2)n1

InChI

InChI=1S/C26H25N5O2/c1-18-17-24(30-26(27-18)31-13-15-33-16-14-31)28-20-9-11-21(12-10-20)29-25(32)23-8-4-6-19-5-2-3-7-22(19)23/h2-12,17H,13-16H2,1H3,(H,29,32)(H,27,28,30)

InChI Key

ADGIOMOPQNEKCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27593357

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.945

Distribution Coefficient, logD

4.332

Water Solubility, LogSw

-5.35

Polar Surface Area

61.203

Acid Dissociation Constant (pKa)

13.84

Base Dissociation Constant (pKb)

7.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

D576-0218 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

GPCR Targeted Library (31838 compounds)

PI3K-Targeted Library (17255 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D576-0218 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D576-0218?
Check Price and Availability of D576-0218, 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 D576-0218 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D576-0218
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D576-0218
  • 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 D576-0218 available by request