M179-3046 Screening compound: 2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-phenylacetamide

M179-3046 Screening compound: 2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-phenylacetamide
M179-3046 Screening compound: 2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M179-3046
2-({6-[4-(3-methoxyphenyl)piperazin-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

M179-3046

Molecular Formula

C23H25N5O2S (C23 H25 N5 O2 S)

Compound Name

2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-phenylacetamide

IUPAC name

2-({6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-phenylacetamide

SMILES

COc1cccc(N(CC2)CCN2c2cc(SCC(Nc3ccccc3)=O)ncn2)c1

InChI

InChI=1S/C23H25N5O2S/c1-30-20-9-5-8-19(14-20)27-10-12-28(13-11-27)21-15-23(25-17-24-21)31-16-22(29)26-18-6-3-2-4-7-18/h2-9,14-15,17H,10-13,16H2,1H3,(H,26,29)

InChI Key

HLNIKNDYYCBRAV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15141137

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.390

Distribution Coefficient, logD

4.390

Water Solubility, LogSw

-4.26

Polar Surface Area

56.007

Acid Dissociation Constant (pKa)

12.75

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with M179-3046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M179-3046?
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What is the minimum amount of M179-3046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M179-3046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M179-3046
  • 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 M179-3046 available by request