Y080-1310 Screening compound: 1-hexyl-2-phenyl-1H-1,3-benzodiazole

Y080-1310 Screening compound: 1-hexyl-2-phenyl-1H-1,3-benzodiazole
Y080-1310 Screening compound: 1-hexyl-2-phenyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1310
1-hexyl-2-phenyl-1H-1,3-benzodiazole

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

Y080-1310

Molecular Formula

C19H22N2 (C19 H22 N2)

Compound Name

1-hexyl-2-phenyl-1H-1,3-benzodiazole

IUPAC name

1-hexyl-2-phenyl-1H-13-benzodiazole

SMILES

CCCCCCn1c(-c2ccccc2)nc2c1cccc2

InChI

InChI=1S/C19H22N2/c1-2-3-4-10-15-21-18-14-9-8-13-17(18)20-19(21)16-11-6-5-7-12-16/h5-9,11-14H,2-4,10,15H2,1H3

InChI Key

OHQUBPBTEYKLKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02859124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

278.4

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

6.192

Distribution Coefficient, logD

6.192

Water Solubility, LogSw

-5.83

Polar Surface Area

10.145

Acid Dissociation Constant (pKa)

23.50

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

Y080-1310 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with Y080-1310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1310?
Check Price and Availability of Y080-1310, 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 Y080-1310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1310
  • 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 Y080-1310 available by request