1227-0208 Screening compound: (4-methoxy-3-methylphenyl)(3-nitrophenyl)methanone

1227-0208 Screening compound: (4-methoxy-3-methylphenyl)(3-nitrophenyl)methanone
1227-0208 Screening compound: (4-methoxy-3-methylphenyl)(3-nitrophenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 1227-0208
(4-methoxy-3-methylphenyl)(3-nitrophenyl)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

1227-0208

Molecular Formula

C15H13NO4 (C15 H13 NO4)

Compound Name

(4-methoxy-3-methylphenyl)(3-nitrophenyl)methanone

IUPAC name

(4-methoxy-3-methylphenyl)(3-nitrophenyl)methanone

SMILES

Cc(cc(cc1)C(c2cccc([N+]([O-])=O)c2)=O)c1OC

InChI

InChI=1S/C15H13NO4/c1-10-8-12(6-7-14(10)20-2)15(17)11-4-3-5-13(9-11)16(18)19/h3-9H,1-2H3

InChI Key

PQOLNYUCSOMRTD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00617173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

271.27

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.878

Distribution Coefficient, logD

3.878

Water Solubility, LogSw

-4.16

Polar Surface Area

54.717

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

1227-0208 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 1227-0208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1227-0208?
Check Price and Availability of 1227-0208, 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 1227-0208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1227-0208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1227-0208
  • 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 1227-0208 available by request