M179-4289 Screening compound: N-(4-bromophenyl)-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide

M179-4289 Screening compound: N-(4-bromophenyl)-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
M179-4289 Screening compound: N-(4-bromophenyl)-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M179-4289
N-(4-bromophenyl)-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide

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

M179-4289

Molecular Formula

C18H21BrN4OS (C18 H21 BrN4 OS)

Compound Name

N-(4-bromophenyl)-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide

IUPAC name

N-(4-bromophenyl)-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide

SMILES

CC(CCCC1)N1c1cc(SCC(Nc(cc2)ccc2Br)=O)ncn1

InChI

InChI=1S/C18H21BrN4OS/c1-13-4-2-3-9-23(13)16-10-18(21-12-20-16)25-11-17(24)22-15-7-5-14(19)6-8-15/h5-8,10,12-13H,2-4,9,11H2,1H3,(H,22,24)/t13-/m0/s1

InChI Key

MPRWZSIWOSWOIS-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD27533393

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.36

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

4.668

Distribution Coefficient, logD

4.667

Water Solubility, LogSw

-4.31

Polar Surface Area

44.488

Acid Dissociation Constant (pKa)

10.95

Base Dissociation Constant (pKb)

4.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.90

References: we are preparing a list of scientific research reports with M179-4289 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M179-4289?
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What is the minimum amount of M179-4289 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M179-4289
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M179-4289
  • 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 M179-4289 available by request