K850-0289 Screening compound: 3-{[(2-methoxyphenyl)carbamoyl]methyl}-N-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

K850-0289 Screening compound: 3-{[(2-methoxyphenyl)carbamoyl]methyl}-N-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
K850-0289 Screening compound: 3-{[(2-methoxyphenyl)carbamoyl]methyl}-N-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K850-0289
3-{[(2-methoxyphenyl)carbamoyl]methyl}-N-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-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

K850-0289

Molecular Formula

C25H24N4O5S (C25 H24 N4 O5 S)

Compound Name

3-{[(2-methoxyphenyl)carbamoyl]methyl}-N-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

3-{[(2-methoxyphenyl)carbamoyl]methyl}-N-[(2-methoxyphenyl)methyl]-5-methyl-4-oxo-3H4H-thieno[23-d]pyrimidine-6-carboxamide

SMILES

Cc1c(C(NCc(cccc2)c2OC)=O)sc(N=CN2CC(Nc(cccc3)c3OC)=O)c1C2=O

InChI

InChI=1S/C25H24N4O5S/c1-15-21-24(35-22(15)23(31)26-12-16-8-4-6-10-18(16)33-2)27-14-29(25(21)32)13-20(30)28-17-9-5-7-11-19(17)34-3/h4-11,14H,12-13H2,1-3H3,(H,26,31)(H,28,30)

InChI Key

AVSMAABHMCCEGY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15110836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.974

Distribution Coefficient, logD

2.974

Water Solubility, LogSw

-3.41

Polar Surface Area

88.367

Acid Dissociation Constant (pKa)

10.59

Base Dissociation Constant (pKb)

0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

K850-0289 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K850-0289 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K850-0289?
Check Price and Availability of K850-0289, 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 K850-0289 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K850-0289
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K850-0289
  • 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 K850-0289 available by request