V027-6883 Screening compound: N-{5-[(cyclopropylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide

V027-6883 Screening compound: N-{5-[(cyclopropylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide
V027-6883 Screening compound: N-{5-[(cyclopropylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-6883
N-{5-[(cyclopropylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide

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

V027-6883

Molecular Formula

C13H12FN3OS2 (C13 H12 FN3 OS2)

Compound Name

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

IUPAC name

N-{5-[(cyclopropylmethyl)sulfanyl]-134-thiadiazol-2-yl}-3-fluorobenzamide

SMILES

O=C(c1cc(F)ccc1)Nc1nnc(SCC2CC2)s1

InChI

InChI=1S/C13H12FN3OS2/c14-10-3-1-2-9(6-10)11(18)15-12-16-17-13(20-12)19-7-8-4-5-8/h1-3,6,8H,4-5,7H2,(H,15,16,18)

InChI Key

WTSBCIMNWQKALN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19857680

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

309.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.956

Distribution Coefficient, logD

3.546

Water Solubility, LogSw

-4.12

Polar Surface Area

46.487

Acid Dissociation Constant (pKa)

7.20

Base Dissociation Constant (pKb)

-3.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

References: we are preparing a list of scientific research reports with V027-6883 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-6883?
Check Price and Availability of V027-6883, 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 V027-6883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-6883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-6883
  • 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 V027-6883 available by request