Y600-3468 Screening compound: 4-[7,8-dimethoxy-1-oxo-3-thioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-1-benzenesulfonamide

Y600-3468 Screening compound: 4-[7,8-dimethoxy-1-oxo-3-thioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-1-benzenesulfonamide
Y600-3468 Screening compound: 4-[7,8-dimethoxy-1-oxo-3-thioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y600-3468
4-[7,8-dimethoxy-1-oxo-3-thioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-1-benzenesulfonamide

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

Y600-3468

Molecular Formula

C19H19N3O5S2 (C19 H19 N3 O5 S2)

Compound Name

4-[7,8-dimethoxy-1-oxo-3-thioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-1-benzenesulfonamide

IUPAC name

4-{78-dimethoxy-1-oxo-3-sulfanylidene-1H2H3H5H10H10aH-imidazo[15-b]isoquinolin-2-yl}benzene-1-sulfonamide

SMILES

COc1cc(CC(C(N2c(cc3)ccc3S(N)(=O)=O)=O)N(C3)C2=S)c3cc1OC

InChI

InChI=1S/C19H19N3O5S2/c1-26-16-8-11-7-15-18(23)22(13-3-5-14(6-4-13)29(20,24)25)19(28)21(15)10-12(11)9-17(16)27-2/h3-6,8-9,15H,7,10H2,1-2H3,(H2,20,24,25)/t15-/m1/s1

InChI Key

QLXQCOJLOXEYDS-OAHLLOKOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.761

Distribution Coefficient, logD

0.760

Water Solubility, LogSw

-2.22

Polar Surface Area

84.564

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

-4.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.32

References: we are preparing a list of scientific research reports with Y600-3468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y600-3468?
Check Price and Availability of Y600-3468, 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 Y600-3468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y600-3468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y600-3468
  • 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 Y600-3468 available by request