K846-0069 Screening compound: 2-{[3-(4-chlorophenyl)-3-oxopropyl]amino}-3-methylpentanoic acid

K846-0069 Screening compound: 2-{[3-(4-chlorophenyl)-3-oxopropyl]amino}-3-methylpentanoic acid
K846-0069 Screening compound: 2-{[3-(4-chlorophenyl)-3-oxopropyl]amino}-3-methylpentanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound K846-0069
2-{[3-(4-chlorophenyl)-3-oxopropyl]amino}-3-methylpentanoic 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

K846-0069

Molecular Formula

C15H20ClNO3 (C15 H20 ClNO3)

Compound Name

2-{[3-(4-chlorophenyl)-3-oxopropyl]amino}-3-methylpentanoic acid

IUPAC name

2-{[3-(4-chlorophenyl)-3-oxopropyl]amino}-3-methylpentanoic acid

SMILES

CCC(C)C(C(O)=O)NCCC(c(cc1)ccc1Cl)=O

InChI

InChI=1S/C15H20ClNO3/c1-3-10(2)14(15(19)20)17-9-8-13(18)11-4-6-12(16)7-5-11/h4-7,10,14,17H,3,8-9H2,1-2H3,(H,19,20)

InChI Key

KMBGQVTXOBOFFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03452468

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.78

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.410

Distribution Coefficient, logD

-1.557

Water Solubility, LogSw

-2.62

Polar Surface Area

52.915

Acid Dissociation Constant (pKa)

2.57

Base Dissociation Constant (pKb)

8.30

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.70

References: we are preparing a list of scientific research reports with K846-0069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K846-0069?
Check Price and Availability of K846-0069, 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 K846-0069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K846-0069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K846-0069
  • 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 K846-0069 available by request