Y204-5689 Screening compound: 3,4-dichloro-N~2~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~2~-methyl-1-benzothiophene-2-carboxamide

Y204-5689 Screening compound: 3,4-dichloro-N~2~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~2~-methyl-1-benzothiophene-2-carboxamide
Y204-5689 Screening compound: 3,4-dichloro-N~2~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~2~-methyl-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y204-5689
3,4-dichloro-N~2~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~2~-methyl-1-benzothiophene-2-carboxamide

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

Y204-5689

Molecular Formula

C16H15Cl2N3OS (C16 H15 Cl2 N3 OS)

Compound Name

3,4-dichloro-N~2~-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N~2~-methyl-1-benzothiophene-2-carboxamide

IUPAC name

34-dichloro-N-[(13-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-1-benzothiophene-2-carboxamide

SMILES

Cc1nn(C)cc1CN(C)C(c(sc1cccc(Cl)c11)c1Cl)=O

InChI

InChI=1S/C16H15Cl2N3OS/c1-9-10(8-21(3)19-9)7-20(2)16(22)15-14(18)13-11(17)5-4-6-12(13)23-15/h4-6,8H,7H2,1-3H3

InChI Key

WQEFITVARAYUNU-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.29

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.669

Distribution Coefficient, logD

3.669

Water Solubility, LogSw

-4.06

Polar Surface Area

32.298

Acid Dissociation Constant (pKa)

24.34

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with Y204-5689 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y204-5689?
Check Price and Availability of Y204-5689, 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 Y204-5689 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y204-5689
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y204-5689
  • 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 Y204-5689 available by request