M179-4100 Screening compound: 2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}-N-phenylacetamide

M179-4100 Screening compound: 2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
M179-4100 Screening compound: 2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M179-4100
2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}-N-phenylacetamide

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

M179-4100

Molecular Formula

C19H24N4OS (C19 H24 N4 OS)

Compound Name

2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}-N-phenylacetamide

IUPAC name

2-{[6-(35-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}-N-phenylacetamide

SMILES

CC(CC(C)C1)CN1c1cc(SCC(Nc2ccccc2)=O)ncn1

InChI

InChI=1S/C19H24N4OS/c1-14-8-15(2)11-23(10-14)17-9-19(21-13-20-17)25-12-18(24)22-16-6-4-3-5-7-16/h3-7,9,13-15H,8,10-12H2,1-2H3,(H,22,24)

InChI Key

WFYBYABCDRXQPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27533337

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.347

Distribution Coefficient, logD

4.347

Water Solubility, LogSw

-4.20

Polar Surface Area

45.070

Acid Dissociation Constant (pKa)

12.75

Base Dissociation Constant (pKb)

2.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with M179-4100 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M179-4100?
Check Price and Availability of M179-4100, 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 M179-4100 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M179-4100
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M179-4100
  • 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 M179-4100 available by request