F599-0280 Screening compound: 2-METHYL-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}BENZAMIDE

F599-0280 Screening compound: 2-METHYL-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}BENZAMIDE
F599-0280 Screening compound: 2-METHYL-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}BENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound F599-0280
2-METHYL-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}BENZAMIDE

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

F599-0280

Molecular Formula

C18H17N7O3S2 (C18 H17 N7 O3 S2)

Compound Name

2-METHYL-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}BENZAMIDE

IUPAC name

n/a

SMILES

Cc(cccc1)c1C(Nc1nnc(Sc2nc(N(C)C(N(C)C3=O)=O)c3n2C)s1)=O

InChI

InChI=1S/C18H17N7O3S2/c1-9-7-5-6-8-10(9)13(26)20-15-21-22-17(29-15)30-16-19-12-11(23(16)2)14(27)25(4)18(28)24(12)3/h5-8H,1-4H3,(H,20,21,26)

InChI Key

KIMNMYNHZJWIHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14960431

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.51

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

3.413

Distribution Coefficient, logD

3.280

Water Solubility, LogSw

-3.87

Polar Surface Area

90.093

Acid Dissociation Constant (pKa)

7.85

Base Dissociation Constant (pKb)

3.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

F599-0280 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F599-0280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F599-0280?
Check Price and Availability of F599-0280, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F599-0280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F599-0280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F599-0280
  • 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 F599-0280 available by request