Y080-0775 Screening compound: (4-methyl-1H-1,3-benzodiazol-2-yl)methanol

Y080-0775 Screening compound: (4-methyl-1H-1,3-benzodiazol-2-yl)methanol
Y080-0775 Screening compound: (4-methyl-1H-1,3-benzodiazol-2-yl)methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-0775
(4-methyl-1H-1,3-benzodiazol-2-yl)methanol

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

Y080-0775

Molecular Formula

C9H10N2O (C9 H10 N2 O)

Compound Name

(4-methyl-1H-1,3-benzodiazol-2-yl)methanol

IUPAC name

(4-methyl-1H-13-benzodiazol-2-yl)methanol

SMILES

Cc1cccc2c1nc(CO)[nH]2

InChI

InChI=1S/C9H10N2O/c1-6-3-2-4-7-9(6)11-8(5-12)10-7/h2-4,12H,5H2,1H3,(H,10,11)

InChI Key

YEBKEULJXVMWID-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09880339

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

162.19

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.505

Distribution Coefficient, logD

1.261

Water Solubility, LogSw

-1.14

Polar Surface Area

38.406

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

7.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

Y080-0775 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Dark Chemical Matter Library (18430 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Proteases
  • Phosphatases
Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y080-0775 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-0775?
Check Price and Availability of Y080-0775, 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 Y080-0775 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-0775
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-0775
  • 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 Y080-0775 available by request