5989-0049 Screening compound: 2-phenyltetrahydro-2H-thiopyran

5989-0049 Screening compound: 2-phenyltetrahydro-2H-thiopyran
5989-0049 Screening compound: 2-phenyltetrahydro-2H-thiopyran alternative view

Chemical Structure Depiction of ChemDiv screening compound 5989-0049
2-phenyltetrahydro-2H-thiopyran

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

5989-0049

Molecular Formula

C11H14S (C11 H14 S)

Compound Name

2-phenyltetrahydro-2H-thiopyran

IUPAC name

2-phenylthiane

SMILES

C1CC(c2ccccc2)SCC1

InChI

InChI=1S/C11H14S/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-3,6-7,11H,4-5,8-9H2/t11-/m0/s1

InChI Key

CFZICUUBJLRTPM-NSHDSACASA-N

MDL Number (MFCD)

MFCD00602701

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

178.3

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

n/a

Partition Coefficient, logP

3.618

Distribution Coefficient, logD

3.618

Water Solubility, LogSw

-3.62

Polar Surface Area

0.000

Acid Dissociation Constant (pKa)

26.70

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.46

5989-0049 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5989-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5989-0049?
Check Price and Availability of 5989-0049, 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 5989-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5989-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5989-0049
  • 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 5989-0049 available by request