Y204-5379 Screening compound: ethyl 2-({4-[2-(ethoxycarbonyl)anilino]-4-oxobutanoyl}amino)benzoate

Y204-5379 Screening compound: ethyl 2-({4-[2-(ethoxycarbonyl)anilino]-4-oxobutanoyl}amino)benzoate
Y204-5379 Screening compound: ethyl 2-({4-[2-(ethoxycarbonyl)anilino]-4-oxobutanoyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y204-5379
ethyl 2-({4-[2-(ethoxycarbonyl)anilino]-4-oxobutanoyl}amino)benzoate

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

Y204-5379

Molecular Formula

C22H24N2O6 (C22 H24 N2 O6)

Compound Name

ethyl 2-({4-[2-(ethoxycarbonyl)anilino]-4-oxobutanoyl}amino)benzoate

IUPAC name

ethyl 2-(3-{[2-(ethoxycarbonyl)phenyl]carbamoyl}propanamido)benzoate

SMILES

CCOC(c(cccc1)c1NC(CCC(Nc(cccc1)c1C(OCC)=O)=O)=O)=O

InChI

InChI=1S/C22H24N2O6/c1-3-29-21(27)15-9-5-7-11-17(15)23-19(25)13-14-20(26)24-18-12-8-6-10-16(18)22(28)30-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,23,25)(H,24,26)

InChI Key

DSGZVMZYGULHOC-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.855

Distribution Coefficient, logD

2.825

Water Solubility, LogSw

-3.39

Polar Surface Area

86.377

Acid Dissociation Constant (pKa)

8.54

Base Dissociation Constant (pKb)

-0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.27

References: we are preparing a list of scientific research reports with Y204-5379 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y204-5379?
Check Price and Availability of Y204-5379, 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 Y204-5379 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y204-5379
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y204-5379
  • 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 Y204-5379 available by request