6705-0123 Screening compound: 3-amino-3-(3-methoxy-4-propoxyphenyl)propanoic acid

6705-0123 Screening compound: 3-amino-3-(3-methoxy-4-propoxyphenyl)propanoic acid
6705-0123 Screening compound: 3-amino-3-(3-methoxy-4-propoxyphenyl)propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 6705-0123
3-amino-3-(3-methoxy-4-propoxyphenyl)propanoic 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

6705-0123

Molecular Formula

C13H19NO4 (C13 H19 NO4)

Compound Name

3-amino-3-(3-methoxy-4-propoxyphenyl)propanoic acid

IUPAC name

3-amino-3-(3-methoxy-4-propoxyphenyl)propanoic acid

SMILES

CCCOc(ccc(C(CC(O)=O)N)c1)c1OC

InChI

InChI=1S/C13H19NO4/c1-3-6-18-11-5-4-9(7-12(11)17-2)10(14)8-13(15)16/h4-5,7,10H,3,6,8,14H2,1-2H3,(H,15,16)/t10-/m0/s1

InChI Key

SNUPQGVALNOUFX-JTQLQIEISA-N

MDL Number (MFCD)

MFCD02140243

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

253.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

-0.080

Distribution Coefficient, logD

-0.080

Water Solubility, LogSw

-1.40

Polar Surface Area

64.546

Acid Dissociation Constant (pKa)

3.83

Base Dissociation Constant (pKb)

10.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

6705-0123 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 6705-0123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6705-0123?
Check Price and Availability of 6705-0123, 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 6705-0123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6705-0123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6705-0123
  • 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 6705-0123 available by request