6623-1102 Screening compound: 1-[1-ethyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one

6623-1102 Screening compound: 1-[1-ethyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
6623-1102 Screening compound: 1-[1-ethyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6623-1102
1-[1-ethyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one

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

6623-1102

Molecular Formula

C19H24N4OS (C19 H24 N4 OS)

Compound Name

1-[1-ethyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one

IUPAC name

1-[1-ethyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-12-dihydropyrimidin-5-yl]ethan-1-one

SMILES

CCN(C(C)=C(C(C)=O)C(N(CC1)CCN1c1ccccc1)=N1)C1=S

InChI

InChI=1S/C19H24N4OS/c1-4-23-14(2)17(15(3)24)18(20-19(23)25)22-12-10-21(11-13-22)16-8-6-5-7-9-16/h5-9H,4,10-13H2,1-3H3

InChI Key

RTDIDWVVPJYUCA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02923346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.320

Distribution Coefficient, logD

2.320

Water Solubility, LogSw

-2.39

Polar Surface Area

30.562

Acid Dissociation Constant (pKa)

23.03

Base Dissociation Constant (pKb)

3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

6623-1102 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 6623-1102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6623-1102?
Check Price and Availability of 6623-1102, 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 6623-1102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6623-1102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6623-1102
  • 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 6623-1102 available by request