V017-7968 Screening compound: N-(3-methoxyphenyl)-N-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide

V017-7968 Screening compound: N-(3-methoxyphenyl)-N-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide
V017-7968 Screening compound: N-(3-methoxyphenyl)-N-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-7968
N-(3-methoxyphenyl)-N-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide

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

V017-7968

Molecular Formula

C27H32N2O4S (C27 H32 N2 O4 S)

Compound Name

N-(3-methoxyphenyl)-N-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide

IUPAC name

N-(3-methoxyphenyl)-N-{1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(N(C1CCN(Cc2cc(OC)ccc2)CC1)c1cc(OC)ccc1)(=O)=O

InChI

InChI=1S/C27H32N2O4S/c1-21-10-12-27(13-11-21)34(30,31)29(24-7-5-9-26(19-24)33-3)23-14-16-28(17-15-23)20-22-6-4-8-25(18-22)32-2/h4-13,18-19,23H,14-17,20H2,1-3H3

InChI Key

IABKZMVLSWMEOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19905854

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

480.63

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

5.767

Distribution Coefficient, logD

4.128

Water Solubility, LogSw

-5.60

Polar Surface Area

50.811

Acid Dissociation Constant (pKa)

25.43

Base Dissociation Constant (pKb)

9.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V017-7968 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with V017-7968 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-7968?
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What is the minimum amount of V017-7968 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-7968
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-7968
  • 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 V017-7968 available by request