D203-0032 Screening compound: 3-[(4-fluorophenyl)methyl]-5-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol

D203-0032 Screening compound: 3-[(4-fluorophenyl)methyl]-5-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
D203-0032 Screening compound: 3-[(4-fluorophenyl)methyl]-5-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D203-0032
3-[(4-fluorophenyl)methyl]-5-{1-[4-(trifluoromethyl)benzoyl]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

D203-0032

Molecular Formula

C24H20F4N6O2 (C24 H20 F4 N6 O2)

Compound Name

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

IUPAC name

3-[(4-fluorophenyl)methyl]-5-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}-3H-[123]triazolo[45-d]pyrimidin-7-ol

SMILES

Oc1c2nnn(Cc(cc3)ccc3F)c2nc(C(CC2)CCN2C(c2ccc(C(F)(F)F)cc2)=O)n1

InChI

InChI=1S/C24H20F4N6O2/c25-18-7-1-14(2-8-18)13-34-21-19(31-32-34)22(35)30-20(29-21)15-9-11-33(12-10-15)23(36)16-3-5-17(6-4-16)24(26,27)28/h1-8,15H,9-13H2,(H,29,30,35)

InChI Key

ZPHLYQNIHPQOCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14813768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.270

Distribution Coefficient, logD

2.816

Water Solubility, LogSw

-3.10

Polar Surface Area

79.202

Acid Dissociation Constant (pKa)

7.13

Base Dissociation Constant (pKb)

0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

D203-0032 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

C-Met Library (15277 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D203-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D203-0032?
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What is the minimum amount of D203-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D203-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D203-0032
  • 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 D203-0032 available by request