Y206-2693 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-1-azepanecarboxamide

Y206-2693 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-1-azepanecarboxamide
Y206-2693 Screening compound: N~1~-(3-chloro-4-fluorophenyl)-1-azepanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y206-2693
N~1~-(3-chloro-4-fluorophenyl)-1-azepanecarboxamide

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

Y206-2693

Molecular Formula

C13H16ClFN2O (C13 H16 ClFN2 O)

Compound Name

N~1~-(3-chloro-4-fluorophenyl)-1-azepanecarboxamide

IUPAC name

N-(3-chloro-4-fluorophenyl)azepane-1-carboxamide

SMILES

O=C(Nc(cc1)cc(Cl)c1F)N1CCCCCC1

InChI

InChI=1S/C13H16ClFN2O/c14-11-9-10(5-6-12(11)15)16-13(18)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8H2,(H,16,18)

InChI Key

VJQXVQDZXSRKKR-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.73

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.688

Distribution Coefficient, logD

3.688

Water Solubility, LogSw

-4.06

Polar Surface Area

26.039

Acid Dissociation Constant (pKa)

10.35

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.15

Y206-2693 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y206-2693 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y206-2693?
Check Price and Availability of Y206-2693, 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 Y206-2693 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y206-2693
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y206-2693
  • 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 Y206-2693 available by request