V016-1829 Screening compound: N-[(4-methoxyphenyl)methyl]-N-[4-({[2-(pyridin-2-yl)ethyl]carbamoyl}methyl)phenyl]cyclopropanecarboxamide

V016-1829 Screening compound: N-[(4-methoxyphenyl)methyl]-N-[4-({[2-(pyridin-2-yl)ethyl]carbamoyl}methyl)phenyl]cyclopropanecarboxamide
V016-1829 Screening compound: N-[(4-methoxyphenyl)methyl]-N-[4-({[2-(pyridin-2-yl)ethyl]carbamoyl}methyl)phenyl]cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-1829
N-[(4-methoxyphenyl)methyl]-N-[4-({[2-(pyridin-2-yl)ethyl]carbamoyl}methyl)phenyl]cyclopropanecarboxamide

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

V016-1829

Molecular Formula

C27H29N3O3 (C27 H29 N3 O3)

Compound Name

N-[(4-methoxyphenyl)methyl]-N-[4-({[2-(pyridin-2-yl)ethyl]carbamoyl}methyl)phenyl]cyclopropanecarboxamide

IUPAC name

N-[(4-methoxyphenyl)methyl]-N-[4-({[2-(pyridin-2-yl)ethyl]carbamoyl}methyl)phenyl]cyclopropanecarboxamide

SMILES

COc1ccc(CN(C(C2CC2)=O)c2ccc(CC(NCCc3ncccc3)=O)cc2)cc1

InChI

InChI=1S/C27H29N3O3/c1-33-25-13-7-21(8-14-25)19-30(27(32)22-9-10-22)24-11-5-20(6-12-24)18-26(31)29-17-15-23-4-2-3-16-28-23/h2-8,11-14,16,22H,9-10,15,17-19H2,1H3,(H,29,31)

InChI Key

SIOSNCDXGVHDPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19902870

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

443.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.221

Distribution Coefficient, logD

3.216

Water Solubility, LogSw

-3.42

Polar Surface Area

57.241

Acid Dissociation Constant (pKa)

14.09

Base Dissociation Constant (pKb)

5.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with V016-1829 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-1829?
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What is the minimum amount of V016-1829 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-1829
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-1829
  • 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 V016-1829 available by request