V030-8266 Screening compound: 4-(5-{[(2-fluoro-3-methylphenyl)methyl]sulfanyl}-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl)-2-phenylquinoline

V030-8266 Screening compound: 4-(5-{[(2-fluoro-3-methylphenyl)methyl]sulfanyl}-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
V030-8266 Screening compound: 4-(5-{[(2-fluoro-3-methylphenyl)methyl]sulfanyl}-4-[(oxolan-2-yl)methyl]-4H-1,2,4-triazol-3-yl)-2-phenylquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-8266
4-(5-{[(2-fluoro-3-methylphenyl)methyl]sulfanyl}-4-[(oxolan-2-yl)methyl]-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

V030-8266

Molecular Formula

C30H27FN4OS (C30 H27 FN4 OS)

Compound Name

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

IUPAC name

4-(5-{[(2-fluoro-3-methylphenyl)methyl]sulfanyl}-4-[(oxolan-2-yl)methyl]-4H-124-triazol-3-yl)-2-phenylquinoline

SMILES

Cc1cccc(CSc2nnc(-c3cc(-c4ccccc4)nc4ccccc34)n2CC2OCCC2)c1F

InChI

InChI=1S/C30H27FN4OS/c1-20-9-7-12-22(28(20)31)19-37-30-34-33-29(35(30)18-23-13-8-16-36-23)25-17-27(21-10-3-2-4-11-21)32-26-15-6-5-14-24(25)26/h2-7,9-12,14-15,17,23H,8,13,16,18-19H2,1H3/t23-/m1/s1

InChI Key

ZJJKRIPYCNCSRI-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19951849

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

510.64

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.243

Distribution Coefficient, logD

7.242

Water Solubility, LogSw

-6.00

Polar Surface Area

40.683

Acid Dissociation Constant (pKa)

18.96

Base Dissociation Constant (pKb)

4.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with V030-8266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-8266?
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What is the minimum amount of V030-8266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-8266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-8266
  • 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 V030-8266 available by request