K915-0842 Screening compound: 2-[6-(3-bromophenyl)-2-(4-chlorophenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol

K915-0842 Screening compound: 2-[6-(3-bromophenyl)-2-(4-chlorophenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol
K915-0842 Screening compound: 2-[6-(3-bromophenyl)-2-(4-chlorophenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound K915-0842
2-[6-(3-bromophenyl)-2-(4-chlorophenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol

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

K915-0842

Molecular Formula

C22H18BrClN2O (C22 H18 BrClN2 O)

Compound Name

2-[6-(3-bromophenyl)-2-(4-chlorophenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]phenol

IUPAC name

2-[6-(3-bromophenyl)-2-(4-chlorophenyl)-2345-tetrahydropyrimidin-4-yl]phenol

SMILES

Oc1c(C(C2)NC(c(cc3)ccc3Cl)N=C2c2cccc(Br)c2)cccc1

InChI

InChI=1S/C22H18BrClN2O/c23-16-5-3-4-15(12-16)19-13-20(18-6-1-2-7-21(18)27)26-22(25-19)14-8-10-17(24)11-9-14/h1-12,20,22,26-27H,13H2

InChI Key

FUBNFRSZFRLGMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03020408

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.75

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.323

Distribution Coefficient, logD

6.276

Water Solubility, LogSw

-6.44

Polar Surface Area

37.162

Acid Dissociation Constant (pKa)

10.58

Base Dissociation Constant (pKb)

6.46

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

13.60

K915-0842 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Hsp90-Targeted Library (11355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K915-0842 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K915-0842?
Check Price and Availability of K915-0842, 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 K915-0842 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K915-0842
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K915-0842
  • 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 K915-0842 available by request