8017-6171 Screening compound: methyl 3-amino-4-(4-methylpiperidino)benzoate

8017-6171 Screening compound: methyl 3-amino-4-(4-methylpiperidino)benzoate
8017-6171 Screening compound: methyl 3-amino-4-(4-methylpiperidino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-6171
methyl 3-amino-4-(4-methylpiperidino)benzoate

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

8017-6171

Molecular Formula

C14H20N2O2 (C14 H20 N2 O2)

Compound Name

methyl 3-amino-4-(4-methylpiperidino)benzoate

IUPAC name

methyl 3-amino-4-(4-methylpiperidin-1-yl)benzoate

SMILES

CC(CC1)CCN1c(ccc(C(OC)=O)c1)c1N

InChI

InChI=1S/C14H20N2O2/c1-10-5-7-16(8-6-10)13-4-3-11(9-12(13)15)14(17)18-2/h3-4,9-10H,5-8,15H2,1-2H3

InChI Key

UVZAQKMDOJJJTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06616917

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.024

Distribution Coefficient, logD

3.024

Water Solubility, LogSw

-3.30

Polar Surface Area

44.660

Acid Dissociation Constant (pKa)

18.98

Base Dissociation Constant (pKb)

4.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

8017-6171 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8017-6171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-6171?
Check Price and Availability of 8017-6171, 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 8017-6171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-6171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-6171
  • 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 8017-6171 available by request