8009-4950 Screening compound: (3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl){4-[(3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl)carbonyl]phenyl}methanone

8009-4950 Screening compound: (3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl){4-[(3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl)carbonyl]phenyl}methanone
8009-4950 Screening compound: (3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl){4-[(3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl)carbonyl]phenyl}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-4950
(3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl){4-[(3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl)carbonyl]phenyl}methanone

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

8009-4950

Molecular Formula

C30H30N4O2S2 (C30 H30 N4 O2 S2)

Compound Name

(3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl){4-[(3-amino-5-ethyl-4,6-dimethylthieno[2,3-b]pyridin-2-yl)carbonyl]phenyl}methanone

IUPAC name

2-(4-{3-amino-5-ethyl-46-dimethylthieno[23-b]pyridine-2-carbonyl}benzoyl)-5-ethyl-46-dimethylthieno[23-b]pyridin-3-amine

SMILES

CCc(c(C)n1)c(C)c2c1sc(C(c(cc1)ccc1C(c(sc1nc(C)c(CC)c(C)c11)c1N)=O)=O)c2N

InChI

InChI=1S/C30H30N4O2S2/c1-7-19-13(3)21-23(31)27(37-29(21)33-15(19)5)25(35)17-9-11-18(12-10-17)26(36)28-24(32)22-14(4)20(8-2)16(6)34-30(22)38-28/h9-12H,7-8,31-32H2,1-6H3

InChI Key

GFEADUKCEIZENR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01210285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

542.73

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.426

Distribution Coefficient, logD

7.425

Water Solubility, LogSw

-5.98

Polar Surface Area

86.540

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

4.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.67

8009-4950 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8009-4950 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-4950?
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What is the minimum amount of 8009-4950 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-4950
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-4950
  • 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 8009-4950 available by request