8013-2106 Screening compound: ethyl 3-[(2-fluorophenyl)formamido]-3-(4-methoxyphenyl)propanoate

8013-2106 Screening compound: ethyl 3-[(2-fluorophenyl)formamido]-3-(4-methoxyphenyl)propanoate
8013-2106 Screening compound: ethyl 3-[(2-fluorophenyl)formamido]-3-(4-methoxyphenyl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-2106
ethyl 3-[(2-fluorophenyl)formamido]-3-(4-methoxyphenyl)propanoate

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

8013-2106

Molecular Formula

C19H20FNO4 (C19 H20 FNO4)

Compound Name

ethyl 3-[(2-fluorophenyl)formamido]-3-(4-methoxyphenyl)propanoate

IUPAC name

ethyl 3-[(2-fluorophenyl)formamido]-3-(4-methoxyphenyl)propanoate

SMILES

CCOC(CC(c(cc1)ccc1OC)NC(c(cccc1)c1F)=O)=O

InChI

InChI=1S/C19H20FNO4/c1-3-25-18(22)12-17(13-8-10-14(24-2)11-9-13)21-19(23)15-6-4-5-7-16(15)20/h4-11,17H,3,12H2,1-2H3,(H,21,23)/t17-/m0/s1

InChI Key

WGWGGAKUIADWNP-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD03763707

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.540

Distribution Coefficient, logD

3.540

Water Solubility, LogSw

-3.74

Polar Surface Area

51.985

Acid Dissociation Constant (pKa)

11.67

Base Dissociation Constant (pKb)

-5.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with 8013-2106 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-2106?
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What is the minimum amount of 8013-2106 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-2106
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-2106
  • 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 8013-2106 available by request