D481-1705 Screening compound: ethyl 2-{2-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate

D481-1705 Screening compound: ethyl 2-{2-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
D481-1705 Screening compound: ethyl 2-{2-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D481-1705
ethyl 2-{2-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate

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

D481-1705

Molecular Formula

C17H18ClN5O3S2 (C17 H18 ClN5 O3 S2)

Compound Name

ethyl 2-{2-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate

IUPAC name

ethyl 2-{2-[2-(4-chloro-35-dimethyl-1H-pyrazol-1-yl)-13-thiazol-4-yl]acetamido}-4-methyl-13-thiazole-5-carboxylate

SMILES

CCOC(c1c(C)nc(NC(Cc2csc(-n3nc(C)c(Cl)c3C)n2)=O)s1)=O

InChI

InChI=1S/C17H18ClN5O3S2/c1-5-26-15(25)14-9(3)19-16(28-14)21-12(24)6-11-7-27-17(20-11)23-10(4)13(18)8(2)22-23/h7H,5-6H2,1-4H3,(H,19,21,24)

InChI Key

OSFYHVUAJJTHAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14831577

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.95

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.802

Distribution Coefficient, logD

3.728

Water Solubility, LogSw

-4.49

Polar Surface Area

79.227

Acid Dissociation Constant (pKa)

8.13

Base Dissociation Constant (pKb)

3.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

D481-1705 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D481-1705 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D481-1705?
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What is the minimum amount of D481-1705 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D481-1705
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D481-1705
  • 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 D481-1705 available by request