4789-3779 Screening compound: N-[2-(diethylamino)ethyl]-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine

4789-3779 Screening compound: N-[2-(diethylamino)ethyl]-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine
4789-3779 Screening compound: N-[2-(diethylamino)ethyl]-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4789-3779
N-[2-(diethylamino)ethyl]-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)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

4789-3779

Molecular Formula

C16H24N4S (C16 H24 N4 S)

Compound Name

N-[2-(diethylamino)ethyl]-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine

IUPAC name

N-[2-(diethylamino)ethyl]-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraen-3-amine

SMILES

CCN(CC)CCNc1c(c(CCCC2)c2s2)c2ncn1

InChI

InChI=1S/C16H24N4S/c1-3-20(4-2)10-9-17-15-14-12-7-5-6-8-13(12)21-16(14)19-11-18-15/h11H,3-10H2,1-2H3,(H,17,18,19)

InChI Key

ORBSBKFHNKECMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00754359

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.881

Distribution Coefficient, logD

1.950

Water Solubility, LogSw

-4.08

Polar Surface Area

35.472

Acid Dissociation Constant (pKa)

16.03

Base Dissociation Constant (pKb)

9.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

4789-3779 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 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

References: we are preparing a list of scientific research reports with 4789-3779 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4789-3779?
Check Price and Availability of 4789-3779, 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 4789-3779 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4789-3779
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4789-3779
  • 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 4789-3779 available by request