L061-0313 Screening compound: N-(3-chlorophenyl)-5-{[(2-ethoxyphenyl)formamido]methyl}-1,3,4-thiadiazole-2-carboxamide

L061-0313 Screening compound: N-(3-chlorophenyl)-5-{[(2-ethoxyphenyl)formamido]methyl}-1,3,4-thiadiazole-2-carboxamide
L061-0313 Screening compound: N-(3-chlorophenyl)-5-{[(2-ethoxyphenyl)formamido]methyl}-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L061-0313
N-(3-chlorophenyl)-5-{[(2-ethoxyphenyl)formamido]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

L061-0313

Molecular Formula

C19H17ClN4O3S (C19 H17 ClN4 O3 S)

Compound Name

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

IUPAC name

N-(3-chlorophenyl)-5-{[(2-ethoxyphenyl)formamido]methyl}-134-thiadiazole-2-carboxamide

SMILES

CCOc(cccc1)c1C(NCc1nnc(C(Nc2cccc(Cl)c2)=O)s1)=O

InChI

InChI=1S/C19H17ClN4O3S/c1-2-27-15-9-4-3-8-14(15)17(25)21-11-16-23-24-19(28-16)18(26)22-13-7-5-6-12(20)10-13/h3-10H,2,11H2,1H3,(H,21,25)(H,22,26)

InChI Key

TWBRANPJVMGOEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27227746

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.89

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

3.985

Distribution Coefficient, logD

3.982

Water Solubility, LogSw

-4.34

Polar Surface Area

78.953

Acid Dissociation Constant (pKa)

9.52

Base Dissociation Constant (pKb)

-1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with L061-0313 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L061-0313?
Check Price and Availability of L061-0313, 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 L061-0313 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L061-0313
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L061-0313
  • 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 L061-0313 available by request