D201-0057 Screening compound: 2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-1-phenylethan-1-ol

D201-0057 Screening compound: 2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-1-phenylethan-1-ol
D201-0057 Screening compound: 2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-1-phenylethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D201-0057
2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-1-phenylethan-1-ol

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

D201-0057

Molecular Formula

C12H14N2OS (C12 H14 N2 OS)

Compound Name

2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-1-phenylethan-1-ol

IUPAC name

2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-1-phenylethan-1-ol

SMILES

Cn1c(SCC(c2ccccc2)O)ncc1

InChI

InChI=1S/C12H14N2OS/c1-14-8-7-13-12(14)16-9-11(15)10-5-3-2-4-6-10/h2-8,11,15H,9H2,1H3/t11-/m0/s1

InChI Key

ZFWNNCVHBLUPJL-NSHDSACASA-N

MDL Number (MFCD)

MFCD09663142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.682

Distribution Coefficient, logD

1.668

Water Solubility, LogSw

-1.60

Polar Surface Area

29.038

Acid Dissociation Constant (pKa)

14.50

Base Dissociation Constant (pKb)

5.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

D201-0057 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Soluble Diversity Library (15920 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D201-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D201-0057?
Check Price and Availability of D201-0057, 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 D201-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D201-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D201-0057
  • 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 D201-0057 available by request