1773-0163 Screening compound: (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol

1773-0163 Screening compound: (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol
1773-0163 Screening compound: (2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1773-0163
(2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)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

1773-0163

Molecular Formula

C13H16N2O (C13 H16 N2 O)

Compound Name

(2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol

IUPAC name

(2-ethyl-1-methyl-1H-imidazol-5-yl)(phenyl)methanol

SMILES

CCc1ncc(C(c2ccccc2)O)n1C

InChI

InChI=1S/C13H16N2O/c1-3-12-14-9-11(15(12)2)13(16)10-7-5-4-6-8-10/h4-9,13,16H,3H2,1-2H3/t13-/m1/s1

InChI Key

UAZJDTSAQSFZKG-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD00967895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

216.28

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.768

Distribution Coefficient, logD

1.686

Water Solubility, LogSw

-1.15

Polar Surface Area

27.924

Acid Dissociation Constant (pKa)

14.53

Base Dissociation Constant (pKb)

6.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.77

1773-0163 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS BBB Library (22607 compounds)

Frequent Hitters Library (7624 compounds)

Soluble Diversity Library (15920 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1773-0163 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1773-0163?
Check Price and Availability of 1773-0163, 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 1773-0163 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1773-0163
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1773-0163
  • 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 1773-0163 available by request