V024-2139 Screening compound: N-{1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl}-N-(4-methylphenyl)butanamide

V024-2139 Screening compound: N-{1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl}-N-(4-methylphenyl)butanamide
V024-2139 Screening compound: N-{1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl}-N-(4-methylphenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-2139
N-{1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl}-N-(4-methylphenyl)butanamide

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

V024-2139

Molecular Formula

C23H28ClN3O3 (C23 H28 ClN3 O3)

Compound Name

N-{1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl}-N-(4-methylphenyl)butanamide

IUPAC name

N-{1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl}-N-(4-methylphenyl)butanamide

SMILES

CCCC(N(C1CCN(Cc(cc(cc2)[N+]([O-])=O)c2Cl)CC1)c1ccc(C)cc1)=O

InChI

InChI=1S/C23H28ClN3O3/c1-3-4-23(28)26(19-7-5-17(2)6-8-19)20-11-13-25(14-12-20)16-18-15-21(27(29)30)9-10-22(18)24/h5-10,15,20H,3-4,11-14,16H2,1-2H3

InChI Key

IUEHQEFJZLYJPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19913367

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

429.95

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.441

Distribution Coefficient, logD

5.372

Water Solubility, LogSw

-5.94

Polar Surface Area

51.608

Acid Dissociation Constant (pKa)

23.46

Base Dissociation Constant (pKb)

6.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

V024-2139 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V024-2139 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-2139?
Check Price and Availability of V024-2139, 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 V024-2139 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-2139
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-2139
  • 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 V024-2139 available by request