D060-0155 Screening compound: 3-[(2-fluorophenyl)methyl]-5-[1-(4-methoxybenzenesulfonyl)piperidin-4-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol

D060-0155 Screening compound: 3-[(2-fluorophenyl)methyl]-5-[1-(4-methoxybenzenesulfonyl)piperidin-4-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
D060-0155 Screening compound: 3-[(2-fluorophenyl)methyl]-5-[1-(4-methoxybenzenesulfonyl)piperidin-4-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D060-0155
3-[(2-fluorophenyl)methyl]-5-[1-(4-methoxybenzenesulfonyl)piperidin-4-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-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

D060-0155

Molecular Formula

C23H23FN6O4S (C23 H23 FN6 O4 S)

Compound Name

3-[(2-fluorophenyl)methyl]-5-[1-(4-methoxybenzenesulfonyl)piperidin-4-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol

IUPAC name

3-[(2-fluorophenyl)methyl]-5-[1-(4-methoxybenzenesulfonyl)piperidin-4-yl]-3H-[123]triazolo[45-d]pyrimidin-7-ol

SMILES

COc(cc1)ccc1S(N(CC1)CCC1c1nc(O)c2nnn(Cc(cccc3)c3F)c2n1)(=O)=O

InChI

InChI=1S/C23H23FN6O4S/c1-34-17-6-8-18(9-7-17)35(32,33)29-12-10-15(11-13-29)21-25-22-20(23(31)26-21)27-28-30(22)14-16-4-2-3-5-19(16)24/h2-9,15H,10-14H2,1H3,(H,25,26,31)

InChI Key

ULVMKBRKGNLEBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811653

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.992

Distribution Coefficient, logD

2.538

Water Solubility, LogSw

-3.10

Polar Surface Area

101.809

Acid Dissociation Constant (pKa)

7.13

Base Dissociation Constant (pKb)

0.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

D060-0155 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiviral Library (67538 compounds)

C-Met Library (15277 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D060-0155 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D060-0155?
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What is the minimum amount of D060-0155 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D060-0155
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D060-0155
  • 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 D060-0155 available by request