K405-0525 Screening compound: 2-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethoxy]ethan-1-ol

K405-0525 Screening compound: 2-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethoxy]ethan-1-ol
K405-0525 Screening compound: 2-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethoxy]ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound K405-0525
2-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethoxy]ethan-1-ol

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

K405-0525

Molecular Formula

C23H21F3N4O2 (C23 H21 F3 N4 O2)

Compound Name

2-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)ethoxy]ethan-1-ol

IUPAC name

2-[2-({5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[23-d]pyrimidin-4-yl}amino)ethoxy]ethan-1-ol

SMILES

OCCOCCNc1c(c(-c2ccccc2)cn2-c3cccc(C(F)(F)F)c3)c2ncn1

InChI

InChI=1S/C23H21F3N4O2/c24-23(25,26)17-7-4-8-18(13-17)30-14-19(16-5-2-1-3-6-16)20-21(28-15-29-22(20)30)27-9-11-32-12-10-31/h1-8,13-15,31H,9-12H2,(H,27,28,29)

InChI Key

BEOBTAXPSAJXIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04450760

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.305

Distribution Coefficient, logD

4.137

Water Solubility, LogSw

-4.46

Polar Surface Area

58.741

Acid Dissociation Constant (pKa)

13.67

Base Dissociation Constant (pKb)

7.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

K405-0525 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with K405-0525 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K405-0525?
Check Price and Availability of K405-0525, 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 K405-0525 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K405-0525
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K405-0525
  • 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 K405-0525 available by request