8012-4854 Screening compound: (4-chloro-3-nitrophenyl)(3,4-dimethylphenyl)methanone

8012-4854 Screening compound: (4-chloro-3-nitrophenyl)(3,4-dimethylphenyl)methanone
8012-4854 Screening compound: (4-chloro-3-nitrophenyl)(3,4-dimethylphenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-4854
(4-chloro-3-nitrophenyl)(3,4-dimethylphenyl)methanone

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

8012-4854

Molecular Formula

C15H12ClNO3 (C15 H12 ClNO3)

Compound Name

(4-chloro-3-nitrophenyl)(3,4-dimethylphenyl)methanone

IUPAC name

(4-chloro-3-nitrophenyl)(34-dimethylphenyl)methanone

SMILES

Cc(cc1)c(C)cc1C(c(cc1)cc([N+]([O-])=O)c1Cl)=O

InChI

InChI=1S/C15H12ClNO3/c1-9-3-4-11(7-10(9)2)15(18)12-5-6-13(16)14(8-12)17(19)20/h3-8H,1-2H3

InChI Key

KBTPJNKKSAWRRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03017849

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.72

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.719

Distribution Coefficient, logD

4.719

Water Solubility, LogSw

-4.97

Polar Surface Area

46.786

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

8012-4854 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8012-4854 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-4854?
Check Price and Availability of 8012-4854, 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 8012-4854 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-4854
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-4854
  • 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 8012-4854 available by request