Y031-6948 Screening compound: N-[3-(dimethylamino)propyl]-2-phenoxybutanamide

Y031-6948 Screening compound: N-[3-(dimethylamino)propyl]-2-phenoxybutanamide
Y031-6948 Screening compound: N-[3-(dimethylamino)propyl]-2-phenoxybutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-6948
N-[3-(dimethylamino)propyl]-2-phenoxybutanamide

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

Y031-6948

Molecular Formula

C15H24N2O2 (C15 H24 N2 O2)

Compound Name

N-[3-(dimethylamino)propyl]-2-phenoxybutanamide

IUPAC name

N-[3-(dimethylamino)propyl]-2-phenoxybutanamide

SMILES

CCC(C(NCCCN(C)C)=O)Oc1ccccc1

InChI

InChI=1S/C15H24N2O2/c1-4-14(19-13-9-6-5-7-10-13)15(18)16-11-8-12-17(2)3/h5-7,9-10,14H,4,8,11-12H2,1-3H3,(H,16,18)/t14-/m0/s1

InChI Key

XAESZPQJQCCZQH-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD03392719

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.882

Distribution Coefficient, logD

-0.590

Water Solubility, LogSw

-2.27

Polar Surface Area

35.303

Acid Dissociation Constant (pKa)

15.22

Base Dissociation Constant (pKb)

9.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.33

Y031-6948 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y031-6948 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-6948?
Check Price and Availability of Y031-6948, 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 Y031-6948 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-6948
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-6948
  • 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 Y031-6948 available by request