Y508-9507 Screening compound: N~1~-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-4-(isopentyloxy)benzamide

Y508-9507 Screening compound: N~1~-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-4-(isopentyloxy)benzamide
Y508-9507 Screening compound: N~1~-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-4-(isopentyloxy)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y508-9507
N~1~-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-4-(isopentyloxy)benzamide

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

Y508-9507

Molecular Formula

C22H26N2O3S (C22 H26 N2 O3 S)

Compound Name

N~1~-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-4-(isopentyloxy)benzamide

IUPAC name

n/a

SMILES

CC(C)CCOc(cc1)ccc1C(Nc(sc1c2CC(C)(C)OC1)c2C#N)=O

InChI

InChI=1S/C22H26N2O3S/c1-14(2)9-10-26-16-7-5-15(6-8-16)20(25)24-21-18(12-23)17-11-22(3,4)27-13-19(17)28-21/h5-8,14H,9-11,13H2,1-4H3,(H,24,25)

InChI Key

PAINUDHOTVJQRF-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.223

Distribution Coefficient, logD

2.900

Water Solubility, LogSw

-5.07

Polar Surface Area

55.216

Acid Dissociation Constant (pKa)

5.08

Base Dissociation Constant (pKb)

-6.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with Y508-9507 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y508-9507?
Check Price and Availability of Y508-9507, 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 Y508-9507 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y508-9507
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y508-9507
  • 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 Y508-9507 available by request