Y041-4081 Screening compound: 2-(2-{[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]formamido}acetamido)acetic acid

Y041-4081 Screening compound: 2-(2-{[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]formamido}acetamido)acetic acid
Y041-4081 Screening compound: 2-(2-{[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]formamido}acetamido)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-4081
2-(2-{[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]formamido}acetamido)acetic acid

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

Y041-4081

Molecular Formula

C15H14ClN3O4S (C15 H14 ClN3 O4 S)

Compound Name

2-(2-{[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]formamido}acetamido)acetic acid

IUPAC name

2-(2-{[2-(4-chlorophenyl)-4-methyl-13-thiazol-5-yl]formamido}acetamido)acetic acid

SMILES

Cc1c(C(NCC(NCC(O)=O)=O)=O)sc(-c(cc2)ccc2Cl)n1

InChI

InChI=1S/C15H14ClN3O4S/c1-8-13(14(23)18-6-11(20)17-7-12(21)22)24-15(19-8)9-2-4-10(16)5-3-9/h2-5H,6-7H2,1H3,(H,17,20)(H,18,23)(H,21,22)

InChI Key

MFUAYDICAONZQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12207996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.81

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.939

Distribution Coefficient, logD

-1.989

Water Solubility, LogSw

-2.92

Polar Surface Area

88.089

Acid Dissociation Constant (pKa)

3.47

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

Y041-4081 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

Cardiovascular Library (22201 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
  • Cardiovascular
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y041-4081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-4081?
Check Price and Availability of Y041-4081, 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 Y041-4081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-4081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-4081
  • 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 Y041-4081 available by request