V016-5159 Screening compound: N-{2-[(2-furylmethyl)amino]-1-[1-(3-methoxybenzoyl)-4-piperidyl]-2-oxoethyl}-4-methylbenzamide

V016-5159 Screening compound: N-{2-[(2-furylmethyl)amino]-1-[1-(3-methoxybenzoyl)-4-piperidyl]-2-oxoethyl}-4-methylbenzamide
V016-5159 Screening compound: N-{2-[(2-furylmethyl)amino]-1-[1-(3-methoxybenzoyl)-4-piperidyl]-2-oxoethyl}-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-5159
N-{2-[(2-furylmethyl)amino]-1-[1-(3-methoxybenzoyl)-4-piperidyl]-2-oxoethyl}-4-methylbenzamide

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

V016-5159

Molecular Formula

C28H31N3O5 (C28 H31 N3 O5)

Compound Name

N-{2-[(2-furylmethyl)amino]-1-[1-(3-methoxybenzoyl)-4-piperidyl]-2-oxoethyl}-4-methylbenzamide

IUPAC name

N-[(furan-2-yl)methyl]-2-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-[(4-methylphenyl)formamido]acetamide

SMILES

Cc(cc1)ccc1C(NC(C(CC1)CCN1C(c1cc(OC)ccc1)=O)C(NCc1ccco1)=O)=O

InChI

InChI=1S/C28H31N3O5/c1-19-8-10-21(11-9-19)26(32)30-25(27(33)29-18-24-7-4-16-36-24)20-12-14-31(15-13-20)28(34)22-5-3-6-23(17-22)35-2/h3-11,16-17,20,25H,12-15,18H2,1-2H3,(H,29,33)(H,30,32)/t25-/m0/s1

InChI Key

UEWDZSZCCJVNIA-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19875663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.441

Distribution Coefficient, logD

3.441

Water Solubility, LogSw

-3.67

Polar Surface Area

80.358

Acid Dissociation Constant (pKa)

11.84

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.14

References: we are preparing a list of scientific research reports with V016-5159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-5159?
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What is the minimum amount of V016-5159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-5159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-5159
  • 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 V016-5159 available by request