K850-0301 Screening compound: methyl 2-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-amido)benzoate

K850-0301 Screening compound: methyl 2-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-amido)benzoate
K850-0301 Screening compound: methyl 2-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-amido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound K850-0301
methyl 2-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-amido)benzoate

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

K850-0301

Molecular Formula

C25H22N4O6S (C25 H22 N4 O6 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(C(Nc(cccc2)c2C(OC)=O)=O)sc(N=CN2CC(Nc(cccc3)c3OC)=O)c1C2=O

InChI

InChI=1S/C25H22N4O6S/c1-14-20-23(36-21(14)22(31)28-16-9-5-4-8-15(16)25(33)35-3)26-13-29(24(20)32)12-19(30)27-17-10-6-7-11-18(17)34-2/h4-11,13H,12H2,1-3H3,(H,27,30)(H,28,31)

InChI Key

QGLPACANKVCKSF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15110841

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.879

Distribution Coefficient, logD

1.648

Water Solubility, LogSw

-3.51

Polar Surface Area

99.890

Acid Dissociation Constant (pKa)

6.20

Base Dissociation Constant (pKb)

0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with K850-0301 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K850-0301?
Check Price and Availability of K850-0301, 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 K850-0301 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K850-0301
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K850-0301
  • 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 K850-0301 available by request