V017-0442 Screening compound: N-{5-[(3-phenoxypropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide

V017-0442 Screening compound: N-{5-[(3-phenoxypropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide
V017-0442 Screening compound: N-{5-[(3-phenoxypropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-0442
N-{5-[(3-phenoxypropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide

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

V017-0442

Molecular Formula

C14H17N3O2S2 (C14 H17 N3 O2 S2)

Compound Name

N-{5-[(3-phenoxypropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide

IUPAC name

N-{5-[(3-phenoxypropyl)sulfanyl]-134-thiadiazol-2-yl}propanamide

SMILES

CCC(Nc1nnc(SCCCOc2ccccc2)s1)=O

InChI

InChI=1S/C14H17N3O2S2/c1-2-12(18)15-13-16-17-14(21-13)20-10-6-9-19-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3,(H,15,16,18)

InChI Key

BLIRAAXSXHBRHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10456803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.731

Distribution Coefficient, logD

3.728

Water Solubility, LogSw

-3.82

Polar Surface Area

53.440

Acid Dissociation Constant (pKa)

9.61

Base Dissociation Constant (pKb)

-3.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V017-0442 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-0442?
Check Price and Availability of V017-0442, 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 V017-0442 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-0442
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-0442
  • 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 V017-0442 available by request