V018-1273 Screening compound: 4-methyl-3-[({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-4H-1,2,4-triazole

V018-1273 Screening compound: 4-methyl-3-[({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-4H-1,2,4-triazole
V018-1273 Screening compound: 4-methyl-3-[({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-1273
4-methyl-3-[({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-4H-1,2,4-triazole

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

V018-1273

Molecular Formula

C14H11F3N4S2 (C14 H11 F3 N4 S2)

Compound Name

4-methyl-3-[({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-4H-1,2,4-triazole

IUPAC name

4-methyl-3-[({2-[4-(trifluoromethyl)phenyl]-13-thiazol-4-yl}methyl)sulfanyl]-4H-124-triazole

SMILES

Cn1c(SCc2csc(-c3ccc(C(F)(F)F)cc3)n2)nnc1

InChI

InChI=1S/C14H11F3N4S2/c1-21-8-18-20-13(21)23-7-11-6-22-12(19-11)9-2-4-10(5-3-9)14(15,16)17/h2-6,8H,7H2,1H3

InChI Key

MYGINZCDVVYTHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19945117

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

356.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.939

Distribution Coefficient, logD

3.938

Water Solubility, LogSw

-4.02

Polar Surface Area

35.962

Acid Dissociation Constant (pKa)

23.26

Base Dissociation Constant (pKb)

5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.43

V018-1273 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V018-1273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-1273?
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What is the minimum amount of V018-1273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-1273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-1273
  • 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 V018-1273 available by request