8018-6809 Screening compound: 2-(2-chlorophenyl)-4,4-diphenyl-2,4-dihydro-1H-3,1-benzoxazine

8018-6809 Screening compound: 2-(2-chlorophenyl)-4,4-diphenyl-2,4-dihydro-1H-3,1-benzoxazine
8018-6809 Screening compound: 2-(2-chlorophenyl)-4,4-diphenyl-2,4-dihydro-1H-3,1-benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-6809
2-(2-chlorophenyl)-4,4-diphenyl-2,4-dihydro-1H-3,1-benzoxazine

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

8018-6809

Molecular Formula

C26H20ClNO (C26 H20 ClNO)

Compound Name

2-(2-chlorophenyl)-4,4-diphenyl-2,4-dihydro-1H-3,1-benzoxazine

IUPAC name

2-(2-chlorophenyl)-44-diphenyl-24-dihydro-1H-31-benzoxazine

SMILES

Clc1c(C2OC(c3ccccc3)(c3ccccc3)c(cccc3)c3N2)cccc1

InChI

InChI=1S/C26H20ClNO/c27-23-17-9-7-15-21(23)25-28-24-18-10-8-16-22(24)26(29-25,19-11-3-1-4-12-19)20-13-5-2-6-14-20/h1-18,25,28H/t25-/m0/s1

InChI Key

VTOWGFHVIWDAPF-VWLOTQADSA-N

MDL Number (MFCD)

MFCD08142435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.9

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.028

Distribution Coefficient, logD

7.028

Water Solubility, LogSw

-6.75

Polar Surface Area

19.262

Acid Dissociation Constant (pKa)

17.03

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

7.70

8018-6809 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 8018-6809 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-6809?
Check Price and Availability of 8018-6809, 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 8018-6809 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-6809
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-6809
  • 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 8018-6809 available by request