K788-9426 Screening compound: 7-chloro-5-(2-fluorophenyl)-3-methyl-1-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}-2,3-dihydro-1H-1,4-benzodiazepin-2-one

K788-9426 Screening compound: 7-chloro-5-(2-fluorophenyl)-3-methyl-1-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}-2,3-dihydro-1H-1,4-benzodiazepin-2-one
K788-9426 Screening compound: 7-chloro-5-(2-fluorophenyl)-3-methyl-1-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}-2,3-dihydro-1H-1,4-benzodiazepin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-9426
7-chloro-5-(2-fluorophenyl)-3-methyl-1-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}-2,3-dihydro-1H-1,4-benzodiazepin-2-one

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

K788-9426

Molecular Formula

C28H23ClFN3O2 (C28 H23 ClFN3 O2)

Compound Name

7-chloro-5-(2-fluorophenyl)-3-methyl-1-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}-2,3-dihydro-1H-1,4-benzodiazepin-2-one

IUPAC name

7-chloro-5-(2-fluorophenyl)-3-methyl-1-{[5-methyl-2-(2-methylphenyl)-13-oxazol-4-yl]methyl}-23-dihydro-1H-14-benzodiazepin-2-one

SMILES

CC1N=C(c(cccc2)c2F)c(cc(cc2)Cl)c2N(Cc2c(C)oc(-c3c(C)cccc3)n2)C1=O

InChI

InChI=1S/C28H23ClFN3O2/c1-16-8-4-5-9-20(16)27-32-24(18(3)35-27)15-33-25-13-12-19(29)14-22(25)26(31-17(2)28(33)34)21-10-6-7-11-23(21)30/h4-14,17H,15H2,1-3H3/t17-/m1/s1

InChI Key

WQRJLUKCZSUCOZ-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD15108509

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.96

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.468

Distribution Coefficient, logD

5.468

Water Solubility, LogSw

-5.78

Polar Surface Area

41.842

Acid Dissociation Constant (pKa)

24.30

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.90

K788-9426 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Bromodomain Modulators Library (5801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Epigenetics Focused Set (26518 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with K788-9426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-9426?
Check Price and Availability of K788-9426, 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 K788-9426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-9426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-9426
  • 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 K788-9426 available by request