V018-5949 Screening compound: N-{1-[1-(4-chlorobenzenesulfonyl)piperidin-4-yl]-2-(morpholin-4-yl)-2-oxoethyl}benzamide

V018-5949 Screening compound: N-{1-[1-(4-chlorobenzenesulfonyl)piperidin-4-yl]-2-(morpholin-4-yl)-2-oxoethyl}benzamide
V018-5949 Screening compound: N-{1-[1-(4-chlorobenzenesulfonyl)piperidin-4-yl]-2-(morpholin-4-yl)-2-oxoethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-5949
N-{1-[1-(4-chlorobenzenesulfonyl)piperidin-4-yl]-2-(morpholin-4-yl)-2-oxoethyl}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

V018-5949

Molecular Formula

C24H28ClN3O5S (C24 H28 ClN3 O5 S)

Compound Name

N-{1-[1-(4-chlorobenzenesulfonyl)piperidin-4-yl]-2-(morpholin-4-yl)-2-oxoethyl}benzamide

IUPAC name

N-{1-[1-(4-chlorobenzenesulfonyl)piperidin-4-yl]-2-(morpholin-4-yl)-2-oxoethyl}benzamide

SMILES

O=C(C(C(CC1)CCN1S(c(cc1)ccc1Cl)(=O)=O)NC(c1ccccc1)=O)N1CCOCC1

InChI

InChI=1S/C24H28ClN3O5S/c25-20-6-8-21(9-7-20)34(31,32)28-12-10-18(11-13-28)22(24(30)27-14-16-33-17-15-27)26-23(29)19-4-2-1-3-5-19/h1-9,18,22H,10-17H2,(H,26,29)/t22-/m0/s1

InChI Key

PAHDASARURYJTE-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19871111

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.02

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.736

Distribution Coefficient, logD

2.736

Water Solubility, LogSw

-3.66

Polar Surface Area

80.272

Acid Dissociation Constant (pKa)

11.24

Base Dissociation Constant (pKb)

-1.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

V018-5949 in Drug Discovery

Included in Screening Libraries

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V018-5949 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-5949?
Check Price and Availability of V018-5949, 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 V018-5949 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-5949
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-5949
  • 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 V018-5949 available by request