6058-0167 Screening compound: 1,1,1-trichloro-3-(2,6-dimethylfuro[2,3-d]pyrimidin-4-yl)-2-propanol

6058-0167 Screening compound: 1,1,1-trichloro-3-(2,6-dimethylfuro[2,3-d]pyrimidin-4-yl)-2-propanol
6058-0167 Screening compound: 1,1,1-trichloro-3-(2,6-dimethylfuro[2,3-d]pyrimidin-4-yl)-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6058-0167
1,1,1-trichloro-3-(2,6-dimethylfuro[2,3-d]pyrimidin-4-yl)-2-propanol

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

6058-0167

Molecular Formula

C11H11Cl3N2O2 (C11 H11 Cl3 N2 O2)

Compound Name

1,1,1-trichloro-3-(2,6-dimethylfuro[2,3-d]pyrimidin-4-yl)-2-propanol

IUPAC name

n/a

SMILES

Cc1cc(c(CC(C(Cl)(Cl)Cl)O)nc(C)n2)c2o1

InChI

InChI=1S/C11H11Cl3N2O2/c1-5-3-7-8(4-9(17)11(12,13)14)15-6(2)16-10(7)18-5/h3,9,17H,4H2,1-2H3/t9-/m0/s1

InChI Key

QVKSPIBOVWKWQY-VIFPVBQESA-N

MDL Number (MFCD)

MFCD03777231

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.929

Distribution Coefficient, logD

2.929

Water Solubility, LogSw

-2.96

Polar Surface Area

43.728

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

6058-0167 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 6058-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6058-0167?
Check Price and Availability of 6058-0167, 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 6058-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6058-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6058-0167
  • 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 6058-0167 available by request