0167-0178 Screening compound: tert-butyl[(4-fluorophenyl)methyl]amine

0167-0178 Screening compound: tert-butyl[(4-fluorophenyl)methyl]amine
0167-0178 Screening compound: tert-butyl[(4-fluorophenyl)methyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0167-0178
tert-butyl[(4-fluorophenyl)methyl]amine

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

0167-0178

Molecular Formula

C11H16FN (C11 H16 FN)

Compound Name

tert-butyl[(4-fluorophenyl)methyl]amine

IUPAC name

tert-butyl[(4-fluorophenyl)methyl]amine

SMILES

CC(C)(C)NCc(cc1)ccc1F

InChI

InChI=1S/C11H16FN/c1-11(2,3)13-8-9-4-6-10(12)7-5-9/h4-7,13H,8H2,1-3H3

InChI Key

LPILEJRPIAXWIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00600578

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

181.25

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

2.471

Distribution Coefficient, logD

0.033

Water Solubility, LogSw

-2.35

Polar Surface Area

10.890

Acid Dissociation Constant (pKa)

26.26

Base Dissociation Constant (pKb)

9.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

0167-0178 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

Cardiovascular Library (22201 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 0167-0178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0167-0178?
Check Price and Availability of 0167-0178, 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 0167-0178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0167-0178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0167-0178
  • 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 0167-0178 available by request