Y200-4022 Screening compound: 3-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}propanoic acid

Y200-4022 Screening compound: 3-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}propanoic acid
Y200-4022 Screening compound: 3-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-4022
3-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}propanoic 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

Y200-4022

Molecular Formula

C18H18ClNO5S (C18 H18 ClNO5 S)

Compound Name

3-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}propanoic acid

IUPAC name

3-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}propanoic acid

SMILES

CCOC(c1c(NC(CCC(O)=O)=O)sc(C)c1-c1cccc(Cl)c1)=O

InChI

InChI=1S/C18H18ClNO5S/c1-3-25-18(24)16-15(11-5-4-6-12(19)9-11)10(2)26-17(16)20-13(21)7-8-14(22)23/h4-6,9H,3,7-8H2,1-2H3,(H,20,21)(H,22,23)

InChI Key

JNHPGCHCTMWUJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02255274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.86

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.235

Distribution Coefficient, logD

0.285

Water Solubility, LogSw

-3.62

Polar Surface Area

72.048

Acid Dissociation Constant (pKa)

4.45

Base Dissociation Constant (pKb)

-6.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

Y200-4022 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with Y200-4022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-4022?
Check Price and Availability of Y200-4022, 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 Y200-4022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-4022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-4022
  • 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 Y200-4022 available by request