V003-8574 Screening compound: 2-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide

V003-8574 Screening compound: 2-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide
V003-8574 Screening compound: 2-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-8574
2-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide

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

V003-8574

Molecular Formula

C22H15Cl2FN2O2 (C22 H15 Cl2 FN2 O2)

Compound Name

2-chloro-N-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide

IUPAC name

2-chloro-N-[(5-chloro-13-benzoxazol-2-yl)methyl]-N-[(4-fluorophenyl)methyl]benzamide

SMILES

O=C(c(cccc1)c1Cl)N(Cc1nc(cc(cc2)Cl)c2o1)Cc(cc1)ccc1F

InChI

InChI=1S/C22H15Cl2FN2O2/c23-15-7-10-20-19(11-15)26-21(29-20)13-27(12-14-5-8-16(25)9-6-14)22(28)17-3-1-2-4-18(17)24/h1-11H,12-13H2

InChI Key

AKZKBLOMBORLOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19962027

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.270

Distribution Coefficient, logD

5.270

Water Solubility, LogSw

-5.64

Polar Surface Area

32.925

Acid Dissociation Constant (pKa)

26.50

Base Dissociation Constant (pKb)

-4.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with V003-8574 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-8574?
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What is the minimum amount of V003-8574 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-8574
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-8574
  • 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 V003-8574 available by request