V010-7617 Screening compound: N-[(4-methoxyphenyl)methyl]-N-[1-(3-methylbutanoyl)piperidin-4-yl]-2-(N-propylbenzenesulfonamido)acetamide

V010-7617 Screening compound: N-[(4-methoxyphenyl)methyl]-N-[1-(3-methylbutanoyl)piperidin-4-yl]-2-(N-propylbenzenesulfonamido)acetamide
V010-7617 Screening compound: N-[(4-methoxyphenyl)methyl]-N-[1-(3-methylbutanoyl)piperidin-4-yl]-2-(N-propylbenzenesulfonamido)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-7617
N-[(4-methoxyphenyl)methyl]-N-[1-(3-methylbutanoyl)piperidin-4-yl]-2-(N-propylbenzenesulfonamido)acetamide

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

V010-7617

Molecular Formula

C29H41N3O5S (C29 H41 N3 O5 S)

Compound Name

N-[(4-methoxyphenyl)methyl]-N-[1-(3-methylbutanoyl)piperidin-4-yl]-2-(N-propylbenzenesulfonamido)acetamide

IUPAC name

N-[(4-methoxyphenyl)methyl]-N-[1-(3-methylbutanoyl)piperidin-4-yl]-2-(N-propylbenzenesulfonamido)acetamide

SMILES

CCCN(CC(N(Cc(cc1)ccc1OC)C(CC1)CCN1C(CC(C)C)=O)=O)S(c1ccccc1)(=O)=O

InChI

InChI=1S/C29H41N3O5S/c1-5-17-31(38(35,36)27-9-7-6-8-10-27)22-29(34)32(21-24-11-13-26(37-4)14-12-24)25-15-18-30(19-16-25)28(33)20-23(2)3/h6-14,23,25H,5,15-22H2,1-4H3

InChI Key

WNYXJGSBOOAWCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19970665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

543.73

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.287

Distribution Coefficient, logD

4.287

Water Solubility, LogSw

-4.08

Polar Surface Area

70.265

Acid Dissociation Constant (pKa)

23.02

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

51.70

V010-7617 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Regenerative Medicine Focused Library (23016 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V010-7617 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-7617?
Check Price and Availability of V010-7617, 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 V010-7617 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-7617
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-7617
  • 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 V010-7617 available by request