Y200-6105 Screening compound: 3-[2-(4-methylphenoxy)propanamido]benzoic acid

Y200-6105 Screening compound: 3-[2-(4-methylphenoxy)propanamido]benzoic acid
Y200-6105 Screening compound: 3-[2-(4-methylphenoxy)propanamido]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-6105
3-[2-(4-methylphenoxy)propanamido]benzoic acid

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

Y200-6105

Molecular Formula

C17H17NO4 (C17 H17 NO4)

Compound Name

3-[2-(4-methylphenoxy)propanamido]benzoic acid

IUPAC name

3-[2-(4-methylphenoxy)propanamido]benzoic acid

SMILES

CC(C(Nc1cccc(C(O)=O)c1)=O)Oc1ccc(C)cc1

InChI

InChI=1S/C17H17NO4/c1-11-6-8-15(9-7-11)22-12(2)16(19)18-14-5-3-4-13(10-14)17(20)21/h3-10,12H,1-2H3,(H,18,19)(H,20,21)/t12-/m0/s1

InChI Key

QZJLHXRPPRGTHL-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD02323189

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.787

Distribution Coefficient, logD

0.901

Water Solubility, LogSw

-3.88

Polar Surface Area

58.527

Acid Dissociation Constant (pKa)

4.51

Base Dissociation Constant (pKb)

-0.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.60

Y200-6105 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y200-6105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-6105?
Check Price and Availability of Y200-6105, 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 Y200-6105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-6105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-6105
  • 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 Y200-6105 available by request