V015-8150 Screening compound: N-{5-[(2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}cyclobutanecarboxamide

V015-8150 Screening compound: N-{5-[(2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}cyclobutanecarboxamide
V015-8150 Screening compound: N-{5-[(2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-8150
N-{5-[(2-phenylethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}cyclobutanecarboxamide

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

V015-8150

Molecular Formula

C15H17N3OS2 (C15 H17 N3 OS2)

Compound Name

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

IUPAC name

N-{5-[(2-phenylethyl)sulfanyl]-134-thiadiazol-2-yl}cyclobutanecarboxamide

SMILES

O=C(C1CCC1)Nc1nnc(SCCc2ccccc2)s1

InChI

InChI=1S/C15H17N3OS2/c19-13(12-7-4-8-12)16-14-17-18-15(21-14)20-10-9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,17,19)

InChI Key

GOPQTEWKLLCJFL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19857795

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.45

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

3.553

Distribution Coefficient, logD

3.545

Water Solubility, LogSw

-3.59

Polar Surface Area

46.487

Acid Dissociation Constant (pKa)

9.16

Base Dissociation Constant (pKb)

-3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V015-8150 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V015-8150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-8150?
Check Price and Availability of V015-8150, 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 V015-8150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-8150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-8150
  • 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 V015-8150 available by request