D481-1663 Screening compound: N-(2-ethoxyphenyl)-2-(2-{4-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1,3-thiazol-4-yl)acetamide

D481-1663 Screening compound: N-(2-ethoxyphenyl)-2-(2-{4-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1,3-thiazol-4-yl)acetamide
D481-1663 Screening compound: N-(2-ethoxyphenyl)-2-(2-{4-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1,3-thiazol-4-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D481-1663
N-(2-ethoxyphenyl)-2-(2-{4-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1,3-thiazol-4-yl)acetamide

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

D481-1663

Molecular Formula

C25H25FN4O2S (C25 H25 FN4 O2 S)

Compound Name

N-(2-ethoxyphenyl)-2-(2-{4-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1,3-thiazol-4-yl)acetamide

IUPAC name

N-(2-ethoxyphenyl)-2-(2-{4-[(3-fluorophenyl)methyl]-35-dimethyl-1H-pyrazol-1-yl}-13-thiazol-4-yl)acetamide

SMILES

CCOc(cccc1)c1NC(Cc1csc(-n2nc(C)c(Cc3cc(F)ccc3)c2C)n1)=O

InChI

InChI=1S/C25H25FN4O2S/c1-4-32-23-11-6-5-10-22(23)28-24(31)14-20-15-33-25(27-20)30-17(3)21(16(2)29-30)13-18-8-7-9-19(26)12-18/h5-12,15H,4,13-14H2,1-3H3,(H,28,31)

InChI Key

BEUYCXZZPOHURK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27588927

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.281

Distribution Coefficient, logD

5.281

Water Solubility, LogSw

-5.17

Polar Surface Area

54.091

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

D481-1663 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D481-1663 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D481-1663?
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What is the minimum amount of D481-1663 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D481-1663
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D481-1663
  • 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 D481-1663 available by request