8014-6512 Screening compound: methyl 11-[(2-chloro-4,5-difluorobenzoyl)amino]undecanoate

8014-6512 Screening compound: methyl 11-[(2-chloro-4,5-difluorobenzoyl)amino]undecanoate
8014-6512 Screening compound: methyl 11-[(2-chloro-4,5-difluorobenzoyl)amino]undecanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-6512
methyl 11-[(2-chloro-4,5-difluorobenzoyl)amino]undecanoate

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

8014-6512

Molecular Formula

C19H26ClF2NO3 (C19 H26 ClF2 NO3)

Compound Name

methyl 11-[(2-chloro-4,5-difluorobenzoyl)amino]undecanoate

IUPAC name

methyl 11-[(2-chloro-45-difluorophenyl)formamido]undecanoate

SMILES

COC(CCCCCCCCCCNC(c(cc(c(F)c1)F)c1Cl)=O)=O

InChI

InChI=1S/C19H26ClF2NO3/c1-26-18(24)10-8-6-4-2-3-5-7-9-11-23-19(25)14-12-16(21)17(22)13-15(14)20/h12-13H,2-11H2,1H3,(H,23,25)

InChI Key

BIOKLMXHEFBUGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03819334

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.507

Distribution Coefficient, logD

5.507

Water Solubility, LogSw

-5.98

Polar Surface Area

45.344

Acid Dissociation Constant (pKa)

10.77

Base Dissociation Constant (pKb)

-2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

References: we are preparing a list of scientific research reports with 8014-6512 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-6512?
Check Price and Availability of 8014-6512, 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 8014-6512 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-6512
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-6512
  • 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 8014-6512 available by request