Y500-9227 Screening compound: diisopropyl 3-methyl-5-({[2-(2-thienyl)-4-quinolyl]carbonyl}amino)-2,4-thiophenedicarboxylate

Y500-9227 Screening compound: diisopropyl 3-methyl-5-({[2-(2-thienyl)-4-quinolyl]carbonyl}amino)-2,4-thiophenedicarboxylate
Y500-9227 Screening compound: diisopropyl 3-methyl-5-({[2-(2-thienyl)-4-quinolyl]carbonyl}amino)-2,4-thiophenedicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y500-9227
diisopropyl 3-methyl-5-({[2-(2-thienyl)-4-quinolyl]carbonyl}amino)-2,4-thiophenedicarboxylate

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

Y500-9227

Molecular Formula

C27H26N2O5S2 (C27 H26 N2 O5 S2)

Compound Name

diisopropyl 3-methyl-5-({[2-(2-thienyl)-4-quinolyl]carbonyl}amino)-2,4-thiophenedicarboxylate

IUPAC name

24-bis(propan-2-yl) 3-methyl-5-[2-(thiophen-2-yl)quinoline-4-amido]thiophene-24-dicarboxylate

SMILES

CC(C)OC(c1c(NC(c2cc(-c3cccs3)nc3ccccc23)=O)sc(C(OC(C)C)=O)c1C)=O

InChI

InChI=1S/C27H26N2O5S2/c1-14(2)33-26(31)22-16(5)23(27(32)34-15(3)4)36-25(22)29-24(30)18-13-20(21-11-8-12-35-21)28-19-10-7-6-9-17(18)19/h6-15H,1-5H3,(H,29,30)

InChI Key

NVVIDAUISSXVKQ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

522.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.638

Distribution Coefficient, logD

4.852

Water Solubility, LogSw

-5.88

Polar Surface Area

73.067

Acid Dissociation Constant (pKa)

5.62

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.93

References: we are preparing a list of scientific research reports with Y500-9227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y500-9227?
Check Price and Availability of Y500-9227, 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 Y500-9227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y500-9227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y500-9227
  • 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 Y500-9227 available by request