8019-3641 Screening compound: dimethyl[2-({2-phenyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)ethyl]amine

8019-3641 Screening compound: dimethyl[2-({2-phenyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)ethyl]amine
8019-3641 Screening compound: dimethyl[2-({2-phenyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)ethyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3641
dimethyl[2-({2-phenyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)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

8019-3641

Molecular Formula

C17H21N3S (C17 H21 N3 S)

Compound Name

dimethyl[2-({2-phenyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)ethyl]amine

IUPAC name

dimethyl[2-({2-phenyl-5H6H7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)ethyl]amine

SMILES

CN(C)CCSc1nc(-c2ccccc2)nc2c1CCC2

InChI

InChI=1S/C17H21N3S/c1-20(2)11-12-21-17-14-9-6-10-15(14)18-16(19-17)13-7-4-3-5-8-13/h3-5,7-8H,6,9-12H2,1-2H3

InChI Key

IQYRIKYSWUXORO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04179141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.004

Distribution Coefficient, logD

2.063

Water Solubility, LogSw

-4.14

Polar Surface Area

24.323

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

9.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

8019-3641 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Human Receptors Annotated Library (5376 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8019-3641 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3641?
Check Price and Availability of 8019-3641, 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 8019-3641 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3641
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3641
  • 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 8019-3641 available by request