Y041-6025 Screening compound: 5-(4-methoxyphenyl)-N~4~-(octahydro-2H-quinolizin-1-ylmethyl)-4-isoxazolecarboxamide

Y041-6025 Screening compound: 5-(4-methoxyphenyl)-N~4~-(octahydro-2H-quinolizin-1-ylmethyl)-4-isoxazolecarboxamide
Y041-6025 Screening compound: 5-(4-methoxyphenyl)-N~4~-(octahydro-2H-quinolizin-1-ylmethyl)-4-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-6025
5-(4-methoxyphenyl)-N~4~-(octahydro-2H-quinolizin-1-ylmethyl)-4-isoxazolecarboxamide

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

Y041-6025

Molecular Formula

C21H27N3O3 (C21 H27 N3 O3)

Compound Name

5-(4-methoxyphenyl)-N~4~-(octahydro-2H-quinolizin-1-ylmethyl)-4-isoxazolecarboxamide

IUPAC name

n/a

SMILES

COc(cc1)ccc1-c(onc1)c1C(NCC1C(CCCC2)N2CCC1)=O

InChI

InChI=1S/C21H27N3O3/c1-26-17-9-7-15(8-10-17)20-18(14-23-27-20)21(25)22-13-16-5-4-12-24-11-3-2-6-19(16)24/h7-10,14,16,19H,2-6,11-13H2,1H3,(H,22,25)

InChI Key

IBAOTBJYHGJRGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27962500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.274

Distribution Coefficient, logD

-0.164

Water Solubility, LogSw

-2.72

Polar Surface Area

57.738

Acid Dissociation Constant (pKa)

14.62

Base Dissociation Constant (pKb)

9.84

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.40

References: we are preparing a list of scientific research reports with Y041-6025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-6025?
Check Price and Availability of Y041-6025, 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 Y041-6025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-6025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-6025
  • 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 Y041-6025 available by request