Y041-3753 Screening compound: [(2H-1,3-benzodioxol-5-yl)methyl][2-(dimethylamino)ethyl]amine

Y041-3753 Screening compound: [(2H-1,3-benzodioxol-5-yl)methyl][2-(dimethylamino)ethyl]amine
Y041-3753 Screening compound: [(2H-1,3-benzodioxol-5-yl)methyl][2-(dimethylamino)ethyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-3753
[(2H-1,3-benzodioxol-5-yl)methyl][2-(dimethylamino)ethyl]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

Y041-3753

Molecular Formula

C12H18N2O2 (C12 H18 N2 O2)

Compound Name

[(2H-1,3-benzodioxol-5-yl)methyl][2-(dimethylamino)ethyl]amine

IUPAC name

[(2H-13-benzodioxol-5-yl)methyl][2-(dimethylamino)ethyl]amine

SMILES

CN(C)CCNCc(cc1)cc2c1OCO2

InChI

InChI=1S/C12H18N2O2/c1-14(2)6-5-13-8-10-3-4-11-12(7-10)16-9-15-11/h3-4,7,13H,5-6,8-9H2,1-2H3

InChI Key

YGHQJIHQMUDTEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07364930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

222.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.238

Distribution Coefficient, logD

-1.650

Water Solubility, LogSw

-1.96

Polar Surface Area

33.098

Acid Dissociation Constant (pKa)

27.15

Base Dissociation Constant (pKb)

10.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

Y041-3753 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y041-3753 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-3753?
Check Price and Availability of Y041-3753, 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 Y041-3753 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-3753
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-3753
  • 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 Y041-3753 available by request