F599-0287 Screening compound: 2,2-dimethyl-N-{5-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide

F599-0287 Screening compound: 2,2-dimethyl-N-{5-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide
F599-0287 Screening compound: 2,2-dimethyl-N-{5-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F599-0287
2,2-dimethyl-N-{5-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide

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

F599-0287

Molecular Formula

C15H19N7O3S2 (C15 H19 N7 O3 S2)

Compound Name

2,2-dimethyl-N-{5-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}propanamide

IUPAC name

22-dimethyl-N-{5-[(137-trimethyl-26-dioxo-2367-tetrahydro-1H-purin-8-yl)sulfanyl]-134-thiadiazol-2-yl}propanamide

SMILES

CC(C)(C)C(Nc1nnc(Sc2nc(N(C)C(N(C)C3=O)=O)c3n2C)s1)=O

InChI

InChI=1S/C15H19N7O3S2/c1-15(2,3)10(24)17-11-18-19-13(26-11)27-12-16-8-7(20(12)4)9(23)22(6)14(25)21(8)5/h1-6H3,(H,17,18,24)

InChI Key

GZCJTRMPXAOJGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27178415

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.785

Distribution Coefficient, logD

2.781

Water Solubility, LogSw

-3.15

Polar Surface Area

90.365

Acid Dissociation Constant (pKa)

9.39

Base Dissociation Constant (pKb)

3.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

F599-0287 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

C-Met Library (15277 compounds)

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Digestive system
  • Respiratory tract
  • 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 F599-0287 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F599-0287?
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What is the minimum amount of F599-0287 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F599-0287
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F599-0287
  • 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 F599-0287 available by request