8016-6001 Screening compound: 4-(aminomethyl)-5-tert-butylfuran-2-carboxylic acid

8016-6001 Screening compound: 4-(aminomethyl)-5-tert-butylfuran-2-carboxylic acid
8016-6001 Screening compound: 4-(aminomethyl)-5-tert-butylfuran-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-6001
4-(aminomethyl)-5-tert-butylfuran-2-carboxylic 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

8016-6001

Molecular Formula

C10H15NO3 (C10 H15 NO3)

Compound Name

4-(aminomethyl)-5-tert-butylfuran-2-carboxylic acid

IUPAC name

4-(aminomethyl)-5-tert-butylfuran-2-carboxylic acid

SMILES

CC(C)(C)c1c(CN)cc(C(O)=O)o1

InChI

InChI=1S/C10H15NO3/c1-10(2,3)8-6(5-11)4-7(14-8)9(12)13/h4H,5,11H2,1-3H3,(H,12,13)

InChI Key

MRGNEVBHLONYBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05857683

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

197.23

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.881

Distribution Coefficient, logD

0.881

Water Solubility, LogSw

-0.87

Polar Surface Area

59.211

Acid Dissociation Constant (pKa)

4.02

Base Dissociation Constant (pKb)

9.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

8016-6001 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8016-6001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-6001?
Check Price and Availability of 8016-6001, 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 8016-6001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-6001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-6001
  • 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 8016-6001 available by request