Y041-1629 Screening compound: 3,4,7-trimethyl-2-oxo-2H-chromen-5-yl 3-(1H-indol-3-yl)-2-(4-methylbenzenesulfonamido)propanoate

Y041-1629 Screening compound: 3,4,7-trimethyl-2-oxo-2H-chromen-5-yl 3-(1H-indol-3-yl)-2-(4-methylbenzenesulfonamido)propanoate
Y041-1629 Screening compound: 3,4,7-trimethyl-2-oxo-2H-chromen-5-yl 3-(1H-indol-3-yl)-2-(4-methylbenzenesulfonamido)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-1629
3,4,7-trimethyl-2-oxo-2H-chromen-5-yl 3-(1H-indol-3-yl)-2-(4-methylbenzenesulfonamido)propanoate

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

Y041-1629

Molecular Formula

C30H28N2O6S (C30 H28 N2 O6 S)

Compound Name

3,4,7-trimethyl-2-oxo-2H-chromen-5-yl 3-(1H-indol-3-yl)-2-(4-methylbenzenesulfonamido)propanoate

IUPAC name

347-trimethyl-2-oxo-2H-chromen-5-yl (2S)-3-(1H-indol-3-yl)-2-(4-methylbenzenesulfonamido)propanoate

SMILES

Cc(cc1)ccc1S(NC(Cc1c[nH]c2c1cccc2)C(Oc1c(C(C)=C(C)C(O2)=O)c2cc(C)c1)=O)(=O)=O

InChI

InChI=1S/C30H28N2O6S/c1-17-9-11-22(12-10-17)39(35,36)32-25(15-21-16-31-24-8-6-5-7-23(21)24)30(34)38-27-14-18(2)13-26-28(27)19(3)20(4)29(33)37-26/h5-14,16,25,31-32H,15H2,1-4H3/t25-/m0/s1

InChI Key

HLKZPFUYNTVCAF-VWLOTQADSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

544.63

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.113

Distribution Coefficient, logD

6.113

Water Solubility, LogSw

-5.78

Polar Surface Area

93.097

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

Y041-1629 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y041-1629 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-1629?
Check Price and Availability of Y041-1629, 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 Y041-1629 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-1629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-1629
  • 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 Y041-1629 available by request