Y501-5240 Screening compound: methyl 4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

Y501-5240 Screening compound: methyl 4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Y501-5240 Screening compound: methyl 4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-5240
methyl 4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

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

Y501-5240

Molecular Formula

C29H33NO6 (C29 H33 NO6)

Compound Name

methyl 4-{5-[(2,6-dimethoxyphenoxy)methyl]-2,4-dimethylphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

IUPAC name

methyl 4-{5-[(26-dimethoxyphenoxy)methyl]-24-dimethylphenyl}-2-methyl-5-oxo-145678-hexahydroquinoline-3-carboxylate

SMILES

Cc1cc(C)c(C2C(C(CCC3)=O)=C3NC(C)=C2C(OC)=O)cc1COc(c(OC)ccc1)c1OC

InChI

InChI=1S/C29H33NO6/c1-16-13-17(2)20(14-19(16)15-36-28-23(33-4)11-8-12-24(28)34-5)26-25(29(32)35-6)18(3)30-21-9-7-10-22(31)27(21)26/h8,11-14,26,30H,7,9-10,15H2,1-6H3/t26-/m0/s1

InChI Key

GVMGHAOMHUSZKP-SANMLTNESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.847

Distribution Coefficient, logD

0.952

Water Solubility, LogSw

-4.74

Polar Surface Area

67.757

Acid Dissociation Constant (pKa)

3.50

Base Dissociation Constant (pKb)

-3.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.93

References: we are preparing a list of scientific research reports with Y501-5240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-5240?
Check Price and Availability of Y501-5240, 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 Y501-5240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-5240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-5240
  • 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 Y501-5240 available by request