3366-5602 Screening compound: N-(4-fluoro-3-nitrophenyl)-2-phenoxybutanamide

3366-5602 Screening compound: N-(4-fluoro-3-nitrophenyl)-2-phenoxybutanamide
3366-5602 Screening compound: N-(4-fluoro-3-nitrophenyl)-2-phenoxybutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3366-5602
N-(4-fluoro-3-nitrophenyl)-2-phenoxybutanamide

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

3366-5602

Molecular Formula

C16H15FN2O4 (C16 H15 FN2 O4)

Compound Name

N-(4-fluoro-3-nitrophenyl)-2-phenoxybutanamide

IUPAC name

N-(4-fluoro-3-nitrophenyl)-2-phenoxybutanamide

SMILES

CCC(C(Nc(cc1)cc([N+]([O-])=O)c1F)=O)Oc1ccccc1

InChI

InChI=1S/C16H15FN2O4/c1-2-15(23-12-6-4-3-5-7-12)16(20)18-11-8-9-13(17)14(10-11)19(21)22/h3-10,15H,2H2,1H3,(H,18,20)/t15-/m0/s1

InChI Key

XYQVGCWCODMPCR-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD01356236

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.742

Distribution Coefficient, logD

3.597

Water Solubility, LogSw

-4.06

Polar Surface Area

63.082

Acid Dissociation Constant (pKa)

7.80

Base Dissociation Constant (pKb)

-2.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.80

3366-5602 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 3366-5602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3366-5602?
Check Price and Availability of 3366-5602, 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 3366-5602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3366-5602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3366-5602
  • 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 3366-5602 available by request