V018-0134 Screening compound: N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide

V018-0134 Screening compound: N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide
V018-0134 Screening compound: N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-0134
N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide

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

V018-0134

Molecular Formula

C16H19N3OS2 (C16 H19 N3 OS2)

Compound Name

N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclopropanecarboxamide

IUPAC name

N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-134-thiadiazol-2-yl]cyclopropanecarboxamide

SMILES

CC(C)c1ccc(CSc2nnc(NC(C3CC3)=O)s2)cc1

InChI

InChI=1S/C16H19N3OS2/c1-10(2)12-5-3-11(4-6-12)9-21-16-19-18-15(22-16)17-14(20)13-7-8-13/h3-6,10,13H,7-9H2,1-2H3,(H,17,18,20)

InChI Key

KMWATXJQLCURAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19857845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.812

Distribution Coefficient, logD

4.810

Water Solubility, LogSw

-4.42

Polar Surface Area

46.487

Acid Dissociation Constant (pKa)

9.87

Base Dissociation Constant (pKb)

-2.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with V018-0134 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-0134?
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What is the minimum amount of V018-0134 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-0134
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-0134
  • 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 V018-0134 available by request