6169-0006 Screening compound: 6-chloro-3-(3-chloro-4-methylphenyl)-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazine

6169-0006 Screening compound: 6-chloro-3-(3-chloro-4-methylphenyl)-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazine
6169-0006 Screening compound: 6-chloro-3-(3-chloro-4-methylphenyl)-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6169-0006
6-chloro-3-(3-chloro-4-methylphenyl)-5,7-dimethyl-3,4-dihydro-2H-1,3-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

6169-0006

Molecular Formula

C17H17Cl2NO (C17 H17 Cl2 NO)

Compound Name

6-chloro-3-(3-chloro-4-methylphenyl)-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazine

IUPAC name

6-chloro-3-(3-chloro-4-methylphenyl)-57-dimethyl-34-dihydro-2H-13-benzoxazine

SMILES

Cc(ccc(N(C1)COc(cc2C)c1c(C)c2Cl)c1)c1Cl

InChI

InChI=1S/C17H17Cl2NO/c1-10-4-5-13(7-15(10)18)20-8-14-12(3)17(19)11(2)6-16(14)21-9-20/h4-7H,8-9H2,1-3H3

InChI Key

WNXJMZVHLBAWTG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03632650

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.23

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

6.267

Distribution Coefficient, logD

6.267

Water Solubility, LogSw

-6.56

Polar Surface Area

12.543

Acid Dissociation Constant (pKa)

25.60

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

6169-0006 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6169-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6169-0006?
Check Price and Availability of 6169-0006, 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 6169-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6169-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6169-0006
  • 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 6169-0006 available by request