L061-0387 Screening compound: N-(3-fluorophenyl)-5-{[2-(4-methoxyphenyl)acetamido]methyl}-1,3,4-thiadiazole-2-carboxamide

L061-0387 Screening compound: N-(3-fluorophenyl)-5-{[2-(4-methoxyphenyl)acetamido]methyl}-1,3,4-thiadiazole-2-carboxamide
L061-0387 Screening compound: N-(3-fluorophenyl)-5-{[2-(4-methoxyphenyl)acetamido]methyl}-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L061-0387
N-(3-fluorophenyl)-5-{[2-(4-methoxyphenyl)acetamido]methyl}-1,3,4-thiadiazole-2-carboxamide

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

L061-0387

Molecular Formula

C19H17FN4O3S (C19 H17 FN4 O3 S)

Compound Name

N-(3-fluorophenyl)-5-{[2-(4-methoxyphenyl)acetamido]methyl}-1,3,4-thiadiazole-2-carboxamide

IUPAC name

N-(3-fluorophenyl)-5-{[2-(4-methoxyphenyl)acetamido]methyl}-134-thiadiazole-2-carboxamide

SMILES

COc1ccc(CC(NCc2nnc(C(Nc3cc(F)ccc3)=O)s2)=O)cc1

InChI

InChI=1S/C19H17FN4O3S/c1-27-15-7-5-12(6-8-15)9-16(25)21-11-17-23-24-19(28-17)18(26)22-14-4-2-3-13(20)10-14/h2-8,10H,9,11H2,1H3,(H,21,25)(H,22,26)

InChI Key

ZQQPPWPPBDSPHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27227779

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.676

Distribution Coefficient, logD

2.673

Water Solubility, LogSw

-3.20

Polar Surface Area

79.073

Acid Dissociation Constant (pKa)

9.52

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with L061-0387 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L061-0387?
Check Price and Availability of L061-0387, 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 L061-0387 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L061-0387
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L061-0387
  • 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 L061-0387 available by request