K913-0133 Screening compound: N-(3-chloro-4-methoxyphenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide

K913-0133 Screening compound: N-(3-chloro-4-methoxyphenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
K913-0133 Screening compound: N-(3-chloro-4-methoxyphenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K913-0133
N-(3-chloro-4-methoxyphenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylthieno[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

K913-0133

Molecular Formula

C25H23ClFN5O2S (C25 H23 ClFN5 O2 S)

Compound Name

N-(3-chloro-4-methoxyphenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

N-(3-chloro-4-methoxyphenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]-5-methylthieno[23-d]pyrimidine-6-carboxamide

SMILES

Cc1c(C(Nc(cc2)cc(Cl)c2OC)=O)sc2c1c(N(CC1)CCN1c(cccc1)c1F)ncn2

InChI

InChI=1S/C25H23ClFN5O2S/c1-15-21-23(32-11-9-31(10-12-32)19-6-4-3-5-18(19)27)28-14-29-25(21)35-22(15)24(33)30-16-7-8-20(34-2)17(26)13-16/h3-8,13-14H,9-12H2,1-2H3,(H,30,33)

InChI Key

JCFFINPBQCTJAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15114010

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.01

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.897

Distribution Coefficient, logD

5.860

Water Solubility, LogSw

-6.02

Polar Surface Area

58.220

Acid Dissociation Constant (pKa)

8.47

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with K913-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K913-0133?
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What is the minimum amount of K913-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K913-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K913-0133
  • 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 K913-0133 available by request