1010-0016 Screening compound: methyl 2-[(2,4,6-trimethylphenyl)amino]propanoate

1010-0016 Screening compound: methyl 2-[(2,4,6-trimethylphenyl)amino]propanoate
1010-0016 Screening compound: methyl 2-[(2,4,6-trimethylphenyl)amino]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1010-0016
methyl 2-[(2,4,6-trimethylphenyl)amino]propanoate

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

1010-0016

Molecular Formula

C13H19NO2 (C13 H19 NO2)

Compound Name

methyl 2-[(2,4,6-trimethylphenyl)amino]propanoate

IUPAC name

methyl 2-[(246-trimethylphenyl)amino]propanoate

SMILES

CC(C(OC)=O)Nc1c(C)cc(C)cc1C

InChI

InChI=1S/C13H19NO2/c1-8-6-9(2)12(10(3)7-8)14-11(4)13(15)16-5/h6-7,11,14H,1-5H3/t11-/m0/s1

InChI Key

JOPXXCORTMWJHX-NSHDSACASA-N

MDL Number (MFCD)

MFCD01534100

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

221.3

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.809

Distribution Coefficient, logD

2.808

Water Solubility, LogSw

-2.97

Polar Surface Area

29.686

Acid Dissociation Constant (pKa)

18.09

Base Dissociation Constant (pKb)

2.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

1010-0016 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1010-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1010-0016?
Check Price and Availability of 1010-0016, 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 1010-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1010-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1010-0016
  • 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 1010-0016 available by request