M422-0129 Screening compound: 5-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-3-(pyridin-2-yl)-1,2-thiazol-4-amine

M422-0129 Screening compound: 5-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-3-(pyridin-2-yl)-1,2-thiazol-4-amine
M422-0129 Screening compound: 5-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-3-(pyridin-2-yl)-1,2-thiazol-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound M422-0129
5-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-3-(pyridin-2-yl)-1,2-thiazol-4-amine

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

M422-0129

Molecular Formula

C21H23N5OS (C21 H23 N5 OS)

Compound Name

5-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-3-(pyridin-2-yl)-1,2-thiazol-4-amine

IUPAC name

5-[4-(24-dimethylphenyl)piperazine-1-carbonyl]-3-(pyridin-2-yl)-12-thiazol-4-amine

SMILES

Cc(cc1)cc(C)c1N(CC1)CCN1C(c(snc1-c2ncccc2)c1N)=O

InChI

InChI=1S/C21H23N5OS/c1-14-6-7-17(15(2)13-14)25-9-11-26(12-10-25)21(27)20-18(22)19(24-28-20)16-5-3-4-8-23-16/h3-8,13H,9-12,22H2,1-2H3

InChI Key

MJEHTNLASLUAJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27540836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.862

Distribution Coefficient, logD

3.862

Water Solubility, LogSw

-4.02

Polar Surface Area

59.271

Acid Dissociation Constant (pKa)

18.68

Base Dissociation Constant (pKb)

4.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

M422-0129 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M422-0129 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M422-0129?
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What is the minimum amount of M422-0129 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M422-0129
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M422-0129
  • 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 M422-0129 available by request