K669-0032 Screening compound: ethyl 4-[(4-chloro-2-methylphenyl)amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate

K669-0032 Screening compound: ethyl 4-[(4-chloro-2-methylphenyl)amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
K669-0032 Screening compound: ethyl 4-[(4-chloro-2-methylphenyl)amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K669-0032
ethyl 4-[(4-chloro-2-methylphenyl)amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate

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

K669-0032

Molecular Formula

C17H16ClN3O2S (C17 H16 ClN3 O2 S)

Compound Name

ethyl 4-[(4-chloro-2-methylphenyl)amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate

IUPAC name

ethyl 4-[(4-chloro-2-methylphenyl)amino]-5-methylthieno[23-d]pyrimidine-6-carboxylate

SMILES

CCOC(c1c(C)c(c(Nc(cc2)c(C)cc2Cl)ncn2)c2s1)=O

InChI

InChI=1S/C17H16ClN3O2S/c1-4-23-17(22)14-10(3)13-15(19-8-20-16(13)24-14)21-12-6-5-11(18)7-9(12)2/h5-8H,4H2,1-3H3,(H,19,20,21)

InChI Key

JDVGLFUPWHBYAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09058447

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.85

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

5.411

Distribution Coefficient, logD

5.408

Water Solubility, LogSw

-5.91

Polar Surface Area

50.761

Acid Dissociation Constant (pKa)

14.68

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

K669-0032 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiviral Library (67538 compounds)

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

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Metabolic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K669-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K669-0032?
Check Price and Availability of K669-0032, 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 K669-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K669-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K669-0032
  • 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 K669-0032 available by request