V008-6984 Screening compound: 4-[5-({[2-fluoro-3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline

V008-6984 Screening compound: 4-[5-({[2-fluoro-3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
V008-6984 Screening compound: 4-[5-({[2-fluoro-3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-6984
4-[5-({[2-fluoro-3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline

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

V008-6984

Molecular Formula

C29H24F4N4OS (C29 H24 F4 N4 OS)

Compound Name

4-[5-({[2-fluoro-3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline

IUPAC name

4-[5-({[2-fluoro-3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-124-triazol-3-yl]-2-phenylquinoline

SMILES

COCCCn1c(SCc(cccc2C(F)(F)F)c2F)nnc1-c1cc(-c2ccccc2)nc2ccccc12

InChI

InChI=1S/C29H24F4N4OS/c1-38-16-8-15-37-27(35-36-28(37)39-18-20-11-7-13-23(26(20)30)29(31,32)33)22-17-25(19-9-3-2-4-10-19)34-24-14-6-5-12-21(22)24/h2-7,9-14,17H,8,15-16,18H2,1H3

InChI Key

QCDXMMOMADKMOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19947026

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

552.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.668

Distribution Coefficient, logD

7.667

Water Solubility, LogSw

-6.07

Polar Surface Area

40.621

Acid Dissociation Constant (pKa)

19.41

Base Dissociation Constant (pKb)

4.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

V008-6984 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V008-6984 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-6984?
Check Price and Availability of V008-6984, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V008-6984 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-6984
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-6984
  • 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 V008-6984 available by request