V017-9248 Screening compound: N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)heptanamide

V017-9248 Screening compound: N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)heptanamide
V017-9248 Screening compound: N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)heptanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-9248
N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)heptanamide

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

V017-9248

Molecular Formula

C16H19F2N3OS2 (C16 H19 F2 N3 OS2)

Compound Name

N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)heptanamide

IUPAC name

N-(5-{[(24-difluorophenyl)methyl]sulfanyl}-134-thiadiazol-2-yl)heptanamide

SMILES

CCCCCCC(Nc1nnc(SCc(ccc(F)c2)c2F)s1)=O

InChI

InChI=1S/C16H19F2N3OS2/c1-2-3-4-5-6-14(22)19-15-20-21-16(24-15)23-10-11-7-8-12(17)9-13(11)18/h7-9H,2-6,10H2,1H3,(H,19,20,22)

InChI Key

ZRLVEDCSZCDKOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19857577

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.455

Distribution Coefficient, logD

5.453

Water Solubility, LogSw

-5.20

Polar Surface Area

46.022

Acid Dissociation Constant (pKa)

9.67

Base Dissociation Constant (pKb)

-4.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with V017-9248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-9248?
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What is the minimum amount of V017-9248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-9248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-9248
  • 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 V017-9248 available by request