P058-0362 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-6-methyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-5-carboxamide

P058-0362 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-6-methyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-5-carboxamide
P058-0362 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-6-methyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P058-0362
N-[(2,4-dimethoxyphenyl)methyl]-6-methyl-4-(piperidin-1-yl)thieno[2,3-d]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

P058-0362

Molecular Formula

C22H26N4O3S (C22 H26 N4 O3 S)

Compound Name

N-[(2,4-dimethoxyphenyl)methyl]-6-methyl-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-5-carboxamide

IUPAC name

N-[(24-dimethoxyphenyl)methyl]-6-methyl-4-(piperidin-1-yl)thieno[23-d]pyrimidine-5-carboxamide

SMILES

Cc1c(C(NCc(ccc(OC)c2)c2OC)=O)c2c(N3CCCCC3)ncnc2s1

InChI

InChI=1S/C22H26N4O3S/c1-14-18(21(27)23-12-15-7-8-16(28-2)11-17(15)29-3)19-20(24-13-25-22(19)30-14)26-9-5-4-6-10-26/h7-8,11,13H,4-6,9-10,12H2,1-3H3,(H,23,27)

InChI Key

MMFYSOISBWSLDC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27561538

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.425

Distribution Coefficient, logD

4.425

Water Solubility, LogSw

-4.65

Polar Surface Area

64.126

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

2.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

P058-0362 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P058-0362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P058-0362?
Check Price and Availability of P058-0362, 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 P058-0362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P058-0362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P058-0362
  • 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 P058-0362 available by request