3899-0039 Screening compound: benzyl 4-(3-{[(4-nitrophenyl)amino]oxy}-3-oxopropyl)-5-oxo-1,3-oxazolidine-3-carboxylate

3899-0039 Screening compound: benzyl 4-(3-{[(4-nitrophenyl)amino]oxy}-3-oxopropyl)-5-oxo-1,3-oxazolidine-3-carboxylate
3899-0039 Screening compound: benzyl 4-(3-{[(4-nitrophenyl)amino]oxy}-3-oxopropyl)-5-oxo-1,3-oxazolidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3899-0039
benzyl 4-(3-{[(4-nitrophenyl)amino]oxy}-3-oxopropyl)-5-oxo-1,3-oxazolidine-3-carboxylate

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

3899-0039

Molecular Formula

C20H19N3O8 (C20 H19 N3 O8)

Compound Name

benzyl 4-(3-{[(4-nitrophenyl)amino]oxy}-3-oxopropyl)-5-oxo-1,3-oxazolidine-3-carboxylate

IUPAC name

benzyl 4-(3-{[(4-nitrophenyl)amino]oxy}-3-oxopropyl)-5-oxo-13-oxazolidine-3-carboxylate

SMILES

[O-][N+](c(cc1)ccc1NOC(CCC(C(OC1)=O)N1C(OCc1ccccc1)=O)=O)=O

InChI

InChI=1S/C20H19N3O8/c24-18(31-21-15-6-8-16(9-7-15)23(27)28)11-10-17-19(25)30-13-22(17)20(26)29-12-14-4-2-1-3-5-14/h1-9,17,21H,10-13H2/t17-/m0/s1

InChI Key

SWMUHAAWCSJTAO-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD00980531

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.39

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.779

Distribution Coefficient, logD

2.778

Water Solubility, LogSw

-3.27

Polar Surface Area

111.387

Acid Dissociation Constant (pKa)

13.66

Base Dissociation Constant (pKb)

4.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 3899-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3899-0039?
Check Price and Availability of 3899-0039, 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 3899-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3899-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3899-0039
  • 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 3899-0039 available by request