V021-3996 Screening compound: N-(4-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(3-methylphenyl)methyl]benzamide

V021-3996 Screening compound: N-(4-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(3-methylphenyl)methyl]benzamide
V021-3996 Screening compound: N-(4-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(3-methylphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-3996
N-(4-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(3-methylphenyl)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

V021-3996

Molecular Formula

C27H28N2O2 (C27 H28 N2 O2)

Compound Name

N-(4-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(3-methylphenyl)methyl]benzamide

IUPAC name

N-(4-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(3-methylphenyl)methyl]benzamide

SMILES

Cc1cccc(CN(C(c2ccccc2)=O)c2ccc(CC(NCC3CC3)=O)cc2)c1

InChI

InChI=1S/C27H28N2O2/c1-20-6-5-7-23(16-20)19-29(27(31)24-8-3-2-4-9-24)25-14-12-21(13-15-25)17-26(30)28-18-22-10-11-22/h2-9,12-16,22H,10-11,17-19H2,1H3,(H,28,30)

InChI Key

LKFQLKNVKRBVRH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19910859

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.866

Distribution Coefficient, logD

4.866

Water Solubility, LogSw

-4.63

Polar Surface Area

40.313

Acid Dissociation Constant (pKa)

15.49

Base Dissociation Constant (pKb)

5.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with V021-3996 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-3996?
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What is the minimum amount of V021-3996 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-3996
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-3996
  • 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 V021-3996 available by request