L062-0421 Screening compound: ethyl 2-{[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]amino}acetate

L062-0421 Screening compound: ethyl 2-{[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]amino}acetate
L062-0421 Screening compound: ethyl 2-{[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]amino}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound L062-0421
ethyl 2-{[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]amino}acetate

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

L062-0421

Molecular Formula

C16H19N5O5S (C16 H19 N5 O5 S)

Compound Name

ethyl 2-{[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]amino}acetate

IUPAC name

ethyl 2-{[({5-[(4-methoxyphenyl)carbamoyl]-134-thiadiazol-2-yl}methyl)carbamoyl]amino}acetate

SMILES

CCOC(CNC(NCc1nnc(C(Nc(cc2)ccc2OC)=O)s1)=O)=O

InChI

InChI=1S/C16H19N5O5S/c1-3-26-13(22)9-18-16(24)17-8-12-20-21-15(27-12)14(23)19-10-4-6-11(25-2)7-5-10/h4-7H,3,8-9H2,1-2H3,(H,19,23)(H2,17,18,24)

InChI Key

RSZXQYDDSJEHNK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27227998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.909

Distribution Coefficient, logD

0.908

Water Solubility, LogSw

-2.26

Polar Surface Area

110.250

Acid Dissociation Constant (pKa)

11.08

Base Dissociation Constant (pKb)

0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

L062-0421 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Epigenetic
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with L062-0421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L062-0421?
Check Price and Availability of L062-0421, 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 L062-0421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L062-0421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L062-0421
  • 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 L062-0421 available by request