V010-8427 Screening compound: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(4-methylbenzenesulfonamido)piperidin-1-yl]benzamide

V010-8427 Screening compound: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(4-methylbenzenesulfonamido)piperidin-1-yl]benzamide
V010-8427 Screening compound: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(4-methylbenzenesulfonamido)piperidin-1-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-8427
N-[2-(2-methoxyphenyl)ethyl]-2-[4-(4-methylbenzenesulfonamido)piperidin-1-yl]benzamide

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

V010-8427

Molecular Formula

C28H33N3O4S (C28 H33 N3 O4 S)

Compound Name

N-[2-(2-methoxyphenyl)ethyl]-2-[4-(4-methylbenzenesulfonamido)piperidin-1-yl]benzamide

IUPAC name

N-[2-(2-methoxyphenyl)ethyl]-2-[4-(4-methylbenzenesulfonamido)piperidin-1-yl]benzamide

SMILES

Cc(cc1)ccc1S(NC(CC1)CCN1c(cccc1)c1C(NCCc(cccc1)c1OC)=O)(=O)=O

InChI

InChI=1S/C28H33N3O4S/c1-21-11-13-24(14-12-21)36(33,34)30-23-16-19-31(20-17-23)26-9-5-4-8-25(26)28(32)29-18-15-22-7-3-6-10-27(22)35-2/h3-14,23,30H,15-20H2,1-2H3,(H,29,32)

InChI Key

ATXRIXZEFFOWPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19894977

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

507.65

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.187

Distribution Coefficient, logD

5.187

Water Solubility, LogSw

-5.04

Polar Surface Area

76.780

Acid Dissociation Constant (pKa)

11.07

Base Dissociation Constant (pKb)

8.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

V010-8427 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V010-8427 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-8427?
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What is the minimum amount of V010-8427 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-8427
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-8427
  • 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 V010-8427 available by request