V020-6682 Screening compound: 2-{6-[2-(3-fluorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-(1-phenylethyl)acetamide

V020-6682 Screening compound: 2-{6-[2-(3-fluorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-(1-phenylethyl)acetamide
V020-6682 Screening compound: 2-{6-[2-(3-fluorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-(1-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-6682
2-{6-[2-(3-fluorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-(1-phenylethyl)acetamide

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

V020-6682

Molecular Formula

C26H23FN2O5 (C26 H23 FN2 O5)

Compound Name

2-{6-[2-(3-fluorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-(1-phenylethyl)acetamide

IUPAC name

2-{6-[2-(3-fluorophenoxy)acetyl]-3-oxo-34-dihydro-2H-14-benzoxazin-4-yl}-N-(1-phenylethyl)acetamide

SMILES

CC(c1ccccc1)NC(CN1c(cc(cc2)C(COc3cccc(F)c3)=O)c2OCC1=O)=O

InChI

InChI=1S/C26H23FN2O5/c1-17(18-6-3-2-4-7-18)28-25(31)14-29-22-12-19(10-11-24(22)34-16-26(29)32)23(30)15-33-21-9-5-8-20(27)13-21/h2-13,17H,14-16H2,1H3,(H,28,31)/t17-/m0/s1

InChI Key

XJMJTCUKHKTKRW-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD19891845

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.239

Distribution Coefficient, logD

3.239

Water Solubility, LogSw

-3.66

Polar Surface Area

68.177

Acid Dissociation Constant (pKa)

12.97

Base Dissociation Constant (pKb)

-0.76

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with V020-6682 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-6682?
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What is the minimum amount of V020-6682 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-6682
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-6682
  • 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 V020-6682 available by request