F042-1082 Screening compound: 2-(2-{[(2-methoxyphenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-(3-methylbutyl)acetamide

F042-1082 Screening compound: 2-(2-{[(2-methoxyphenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-(3-methylbutyl)acetamide
F042-1082 Screening compound: 2-(2-{[(2-methoxyphenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-(3-methylbutyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F042-1082
2-(2-{[(2-methoxyphenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-(3-methylbutyl)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

F042-1082

Molecular Formula

C18H24N4O3S (C18 H24 N4 O3 S)

Compound Name

2-(2-{[(2-methoxyphenyl)carbamoyl]amino}-1,3-thiazol-4-yl)-N-(3-methylbutyl)acetamide

IUPAC name

2-(2-{[(2-methoxyphenyl)carbamoyl]amino}-13-thiazol-4-yl)-N-(3-methylbutyl)acetamide

SMILES

CC(C)CCNC(Cc1csc(NC(Nc(cccc2)c2OC)=O)n1)=O

InChI

InChI=1S/C18H24N4O3S/c1-12(2)8-9-19-16(23)10-13-11-26-18(20-13)22-17(24)21-14-6-4-5-7-15(14)25-3/h4-7,11-12H,8-10H2,1-3H3,(H,19,23)(H2,20,21,22,24)

InChI Key

NYBNAKALZFNJIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08535103

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.511

Distribution Coefficient, logD

3.511

Water Solubility, LogSw

-3.83

Polar Surface Area

74.329

Acid Dissociation Constant (pKa)

11.20

Base Dissociation Constant (pKb)

0.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

F042-1082 in Drug Discovery

Included in Screening Libraries

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

PI3K-Targeted Library (17255 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F042-1082 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F042-1082?
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What is the minimum amount of F042-1082 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F042-1082
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F042-1082
  • 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 F042-1082 available by request