V021-5622 Screening compound: N-[(4-fluorophenyl)methyl]-N-[3-({[2-(4-methoxyphenyl)ethyl]carbamoyl}methyl)phenyl]benzamide

V021-5622 Screening compound: N-[(4-fluorophenyl)methyl]-N-[3-({[2-(4-methoxyphenyl)ethyl]carbamoyl}methyl)phenyl]benzamide
V021-5622 Screening compound: N-[(4-fluorophenyl)methyl]-N-[3-({[2-(4-methoxyphenyl)ethyl]carbamoyl}methyl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-5622
N-[(4-fluorophenyl)methyl]-N-[3-({[2-(4-methoxyphenyl)ethyl]carbamoyl}methyl)phenyl]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

V021-5622

Molecular Formula

C31H29FN2O3 (C31 H29 FN2 O3)

Compound Name

N-[(4-fluorophenyl)methyl]-N-[3-({[2-(4-methoxyphenyl)ethyl]carbamoyl}methyl)phenyl]benzamide

IUPAC name

N-[(4-fluorophenyl)methyl]-N-[3-({[2-(4-methoxyphenyl)ethyl]carbamoyl}methyl)phenyl]benzamide

SMILES

COc1ccc(CCNC(Cc2cccc(N(Cc(cc3)ccc3F)C(c3ccccc3)=O)c2)=O)cc1

InChI

InChI=1S/C31H29FN2O3/c1-37-29-16-12-23(13-17-29)18-19-33-30(35)21-25-6-5-9-28(20-25)34(22-24-10-14-27(32)15-11-24)31(36)26-7-3-2-4-8-26/h2-17,20H,18-19,21-22H2,1H3,(H,33,35)

InChI Key

HGLQONMJRUHMMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19915466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.820

Distribution Coefficient, logD

4.820

Water Solubility, LogSw

-4.64

Polar Surface Area

47.175

Acid Dissociation Constant (pKa)

13.96

Base Dissociation Constant (pKb)

3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.10

References: we are preparing a list of scientific research reports with V021-5622 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-5622?
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What is the minimum amount of V021-5622 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-5622
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-5622
  • 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 V021-5622 available by request