6228-1051 Screening compound: 6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinethiol

6228-1051 Screening compound: 6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinethiol
6228-1051 Screening compound: 6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinethiol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6228-1051
6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinethiol

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

6228-1051

Molecular Formula

C10H11F3N2S (C10 H11 F3 N2 S)

Compound Name

6-methyl-4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinethiol

IUPAC name

6-methyl-4-(trifluoromethyl)-5678-tetrahydroquinazoline-2-thiol

SMILES

CC(CCc1n2)Cc1c(C(F)(F)F)nc2S

InChI

InChI=1S/C10H11F3N2S/c1-5-2-3-7-6(4-5)8(10(11,12)13)15-9(16)14-7/h5H,2-4H2,1H3,(H,14,15,16)/t5-/m1/s1

InChI Key

RCFWBNFCTXKAOV-RXMQYKEDSA-N

MDL Number (MFCD)

MFCD14711332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.353

Distribution Coefficient, logD

2.292

Water Solubility, LogSw

-3.67

Polar Surface Area

18.600

Acid Dissociation Constant (pKa)

6.38

Base Dissociation Constant (pKb)

-0.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

6228-1051 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6228-1051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6228-1051?
Check Price and Availability of 6228-1051, 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 6228-1051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6228-1051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6228-1051
  • 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 6228-1051 available by request