8018-8980 Screening compound: N-(1,1,1,3,3,3-hexafluoro-2-{[(pyridin-3-yl)methyl]amino}propan-2-yl)-2-methylbenzamide

8018-8980 Screening compound: N-(1,1,1,3,3,3-hexafluoro-2-{[(pyridin-3-yl)methyl]amino}propan-2-yl)-2-methylbenzamide
8018-8980 Screening compound: N-(1,1,1,3,3,3-hexafluoro-2-{[(pyridin-3-yl)methyl]amino}propan-2-yl)-2-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8980
N-(1,1,1,3,3,3-hexafluoro-2-{[(pyridin-3-yl)methyl]amino}propan-2-yl)-2-methylbenzamide

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

8018-8980

Molecular Formula

C17H15F6N3O (C17 H15 F6 N3 O)

Compound Name

N-(1,1,1,3,3,3-hexafluoro-2-{[(pyridin-3-yl)methyl]amino}propan-2-yl)-2-methylbenzamide

IUPAC name

N-(111333-hexafluoro-2-{[(pyridin-3-yl)methyl]amino}propan-2-yl)-2-methylbenzamide

SMILES

Cc(cccc1)c1C(NC(C(F)(F)F)(C(F)(F)F)NCc1cnccc1)=O

InChI

InChI=1S/C17H15F6N3O/c1-11-5-2-3-7-13(11)14(27)26-15(16(18,19)20,17(21,22)23)25-10-12-6-4-8-24-9-12/h2-9,25H,10H2,1H3,(H,26,27)

InChI Key

RSPLXDZVSSFNDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00789406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.071

Distribution Coefficient, logD

-1.554

Water Solubility, LogSw

-3.28

Polar Surface Area

44.367

Acid Dissociation Constant (pKa)

2.78

Base Dissociation Constant (pKb)

4.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with 8018-8980 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8980?
Check Price and Availability of 8018-8980, 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 8018-8980 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8980
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8980
  • 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 8018-8980 available by request