Y204-3245 Screening compound: 4-(propoxycarbonyl)phenyl 3-nitrobenzoate

Y204-3245 Screening compound: 4-(propoxycarbonyl)phenyl 3-nitrobenzoate
Y204-3245 Screening compound: 4-(propoxycarbonyl)phenyl 3-nitrobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y204-3245
4-(propoxycarbonyl)phenyl 3-nitrobenzoate

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

Y204-3245

Molecular Formula

C17H15NO6 (C17 H15 NO6)

Compound Name

4-(propoxycarbonyl)phenyl 3-nitrobenzoate

IUPAC name

4-(propoxycarbonyl)phenyl 3-nitrobenzoate

SMILES

CCCOC(c(cc1)ccc1OC(c1cccc([N+]([O-])=O)c1)=O)=O

InChI

InChI=1S/C17H15NO6/c1-2-10-23-16(19)12-6-8-15(9-7-12)24-17(20)13-4-3-5-14(11-13)18(21)22/h3-9,11H,2,10H2,1H3

InChI Key

KODPZKDAIPOEAG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.31

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.228

Distribution Coefficient, logD

4.228

Water Solubility, LogSw

-4.38

Polar Surface Area

75.046

Acid Dissociation Constant (pKa)

27.80

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.65

References: we are preparing a list of scientific research reports with Y204-3245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y204-3245?
Check Price and Availability of Y204-3245, 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 Y204-3245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y204-3245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y204-3245
  • 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 Y204-3245 available by request