V016-3810 Screening compound: N-benzyl-N-[4-({[(pyridin-2-yl)methyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide

V016-3810 Screening compound: N-benzyl-N-[4-({[(pyridin-2-yl)methyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide
V016-3810 Screening compound: N-benzyl-N-[4-({[(pyridin-2-yl)methyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-3810
N-benzyl-N-[4-({[(pyridin-2-yl)methyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide

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

V016-3810

Molecular Formula

C27H29N3O2 (C27 H29 N3 O2)

Compound Name

N-benzyl-N-[4-({[(pyridin-2-yl)methyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide

IUPAC name

N-benzyl-N-[4-({[(pyridin-2-yl)methyl]carbamoyl}methyl)phenyl]cyclopentanecarboxamide

SMILES

O=C(Cc(cc1)ccc1N(Cc1ccccc1)C(C1CCCC1)=O)NCc1ncccc1

InChI

InChI=1S/C27H29N3O2/c31-26(29-19-24-12-6-7-17-28-24)18-21-13-15-25(16-14-21)30(20-22-8-2-1-3-9-22)27(32)23-10-4-5-11-23/h1-3,6-9,12-17,23H,4-5,10-11,18-20H2,(H,29,31)

InChI Key

GPMRCTPAFKJJIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19903308

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

427.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.245

Distribution Coefficient, logD

4.245

Water Solubility, LogSw

-4.30

Polar Surface Area

49.891

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

V016-3810 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V016-3810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-3810?
Check Price and Availability of V016-3810, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V016-3810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-3810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-3810
  • 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 V016-3810 available by request