L061-0276 Screening compound: N-(3-chlorophenyl)-5-{[2-(3,4-dimethoxyphenyl)acetamido]methyl}-1,3,4-thiadiazole-2-carboxamide

L061-0276 Screening compound: N-(3-chlorophenyl)-5-{[2-(3,4-dimethoxyphenyl)acetamido]methyl}-1,3,4-thiadiazole-2-carboxamide
L061-0276 Screening compound: N-(3-chlorophenyl)-5-{[2-(3,4-dimethoxyphenyl)acetamido]methyl}-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L061-0276
N-(3-chlorophenyl)-5-{[2-(3,4-dimethoxyphenyl)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

L061-0276

Molecular Formula

C20H19ClN4O4S (C20 H19 ClN4 O4 S)

Compound Name

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

IUPAC name

N-(3-chlorophenyl)-5-{[2-(34-dimethoxyphenyl)acetamido]methyl}-134-thiadiazole-2-carboxamide

SMILES

COc(ccc(CC(NCc1nnc(C(Nc2cccc(Cl)c2)=O)s1)=O)c1)c1OC

InChI

InChI=1S/C20H19ClN4O4S/c1-28-15-7-6-12(8-16(15)29-2)9-17(26)22-11-18-24-25-20(30-18)19(27)23-14-5-3-4-13(21)10-14/h3-8,10H,9,11H2,1-2H3,(H,22,26)(H,23,27)

InChI Key

ZWZYXXXPPPQAAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27227729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.91

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.912

Distribution Coefficient, logD

2.909

Water Solubility, LogSw

-3.54

Polar Surface Area

86.790

Acid Dissociation Constant (pKa)

9.52

Base Dissociation Constant (pKb)

-1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with L061-0276 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L061-0276?
Check Price and Availability of L061-0276, 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 L061-0276 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L061-0276
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L061-0276
  • 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 L061-0276 available by request