V030-5149 Screening compound: N-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(4-methoxyphenyl)acetamide

V030-5149 Screening compound: N-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(4-methoxyphenyl)acetamide
V030-5149 Screening compound: N-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(4-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-5149
N-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(4-methoxyphenyl)acetamide

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

V030-5149

Molecular Formula

C18H15F2N3O2S2 (C18 H15 F2 N3 O2 S2)

Compound Name

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

IUPAC name

N-(5-{[(35-difluorophenyl)methyl]sulfanyl}-134-thiadiazol-2-yl)-2-(4-methoxyphenyl)acetamide

SMILES

COc1ccc(CC(Nc2nnc(SCc3cc(F)cc(F)c3)s2)=O)cc1

InChI

InChI=1S/C18H15F2N3O2S2/c1-25-15-4-2-11(3-5-15)8-16(24)21-17-22-23-18(27-17)26-10-12-6-13(19)9-14(20)7-12/h2-7,9H,8,10H2,1H3,(H,21,22,24)

InChI Key

NBVSRYOMTBYVDX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19857657

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

407.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.669

Distribution Coefficient, logD

4.663

Water Solubility, LogSw

-4.51

Polar Surface Area

53.294

Acid Dissociation Constant (pKa)

9.25

Base Dissociation Constant (pKb)

-3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with V030-5149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-5149?
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What is the minimum amount of V030-5149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-5149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-5149
  • 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 V030-5149 available by request