M213-1186 Screening compound: 3-[1-(2,5-difluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(3,5-dimethoxyphenyl)-1,2,4-thiadiazol-5-amine

M213-1186 Screening compound: 3-[1-(2,5-difluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(3,5-dimethoxyphenyl)-1,2,4-thiadiazol-5-amine
M213-1186 Screening compound: 3-[1-(2,5-difluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(3,5-dimethoxyphenyl)-1,2,4-thiadiazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound M213-1186
3-[1-(2,5-difluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(3,5-dimethoxyphenyl)-1,2,4-thiadiazol-5-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

M213-1186

Molecular Formula

C19H16F2N6O2S (C19 H16 F2 N6 O2 S)

Compound Name

3-[1-(2,5-difluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-N-(3,5-dimethoxyphenyl)-1,2,4-thiadiazol-5-amine

IUPAC name

3-[1-(25-difluorophenyl)-5-methyl-1H-123-triazol-4-yl]-N-(35-dimethoxyphenyl)-124-thiadiazol-5-amine

SMILES

Cc1c(-c2nsc(Nc3cc(OC)cc(OC)c3)n2)nnn1-c(cc(cc1)F)c1F

InChI

InChI=1S/C19H16F2N6O2S/c1-10-17(24-26-27(10)16-6-11(20)4-5-15(16)21)18-23-19(30-25-18)22-12-7-13(28-2)9-14(8-12)29-3/h4-9H,1-3H3,(H,22,23,25)

InChI Key

LBQFKROWNHPNSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27534282

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.502

Distribution Coefficient, logD

4.502

Water Solubility, LogSw

-4.36

Polar Surface Area

71.368

Acid Dissociation Constant (pKa)

17.88

Base Dissociation Constant (pKb)

-1.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

M213-1186 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M213-1186 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M213-1186?
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What is the minimum amount of M213-1186 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M213-1186
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M213-1186
  • 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 M213-1186 available by request