D442-0376 Screening compound: N-[2-(dimethylamino)ethyl]-N-[(2,2-dimethyltetrahydro-2H-pyran-4-yl)methyl]-N-(2-thienylmethyl)amine

D442-0376 Screening compound: N-[2-(dimethylamino)ethyl]-N-[(2,2-dimethyltetrahydro-2H-pyran-4-yl)methyl]-N-(2-thienylmethyl)amine
D442-0376 Screening compound: N-[2-(dimethylamino)ethyl]-N-[(2,2-dimethyltetrahydro-2H-pyran-4-yl)methyl]-N-(2-thienylmethyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D442-0376
N-[2-(dimethylamino)ethyl]-N-[(2,2-dimethyltetrahydro-2H-pyran-4-yl)methyl]-N-(2-thienylmethyl)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

D442-0376

Molecular Formula

C17H30N2OS (C17 H30 N2 OS)

Compound Name

N-[2-(dimethylamino)ethyl]-N-[(2,2-dimethyltetrahydro-2H-pyran-4-yl)methyl]-N-(2-thienylmethyl)amine

IUPAC name

n/a

SMILES

CC1(C)OCCC(CN(CCN(C)C)Cc2cccs2)C1

InChI

InChI=1S/C17H30N2OS/c1-17(2)12-15(7-10-20-17)13-19(9-8-18(3)4)14-16-6-5-11-21-16/h5-6,11,15H,7-10,12-14H2,1-4H3/t15-/m0/s1

InChI Key

RRNGTPCUDMLNBW-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD14829244

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.038

Distribution Coefficient, logD

1.708

Water Solubility, LogSw

-2.96

Polar Surface Area

16.204

Acid Dissociation Constant (pKa)

25.47

Base Dissociation Constant (pKb)

8.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

76.50

D442-0376 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with D442-0376 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D442-0376?
Check Price and Availability of D442-0376, 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 D442-0376 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D442-0376
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D442-0376
  • 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 D442-0376 available by request