Y300-2196 Screening compound: N-({4-[(1-methylpiperidin-4-yl)oxy]phenyl}methyl)-3-(morpholine-4-sulfonyl)benzamide

Y300-2196 Screening compound: N-({4-[(1-methylpiperidin-4-yl)oxy]phenyl}methyl)-3-(morpholine-4-sulfonyl)benzamide
Y300-2196 Screening compound: N-({4-[(1-methylpiperidin-4-yl)oxy]phenyl}methyl)-3-(morpholine-4-sulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y300-2196
N-({4-[(1-methylpiperidin-4-yl)oxy]phenyl}methyl)-3-(morpholine-4-sulfonyl)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

Y300-2196

Molecular Formula

C24H31N3O5S (C24 H31 N3 O5 S)

Compound Name

N-({4-[(1-methylpiperidin-4-yl)oxy]phenyl}methyl)-3-(morpholine-4-sulfonyl)benzamide

IUPAC name

N-({4-[(1-methylpiperidin-4-yl)oxy]phenyl}methyl)-3-(morpholine-4-sulfonyl)benzamide

SMILES

CN(CC1)CCC1Oc1ccc(CNC(c2cccc(S(N3CCOCC3)(=O)=O)c2)=O)cc1

InChI

InChI=1S/C24H31N3O5S/c1-26-11-9-22(10-12-26)32-21-7-5-19(6-8-21)18-25-24(28)20-3-2-4-23(17-20)33(29,30)27-13-15-31-16-14-27/h2-8,17,22H,9-16,18H2,1H3,(H,25,28)

InChI Key

BSZXCHPBSYJBFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18488114

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.59

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

1.679

Distribution Coefficient, logD

-0.308

Water Solubility, LogSw

-2.62

Polar Surface Area

74.202

Acid Dissociation Constant (pKa)

12.04

Base Dissociation Constant (pKb)

9.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.80

Y300-2196 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with Y300-2196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y300-2196?
Check Price and Availability of Y300-2196, 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 Y300-2196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y300-2196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y300-2196
  • 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 Y300-2196 available by request