7169-3749 Screening compound: propan-2-yl 3-{3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-amido}benzoate

7169-3749 Screening compound: propan-2-yl 3-{3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-amido}benzoate
7169-3749 Screening compound: propan-2-yl 3-{3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7169-3749
propan-2-yl 3-{3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-amido}benzoate

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

7169-3749

Molecular Formula

C20H21N3O3S (C20 H21 N3 O3 S)

Compound Name

propan-2-yl 3-{3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-amido}benzoate

IUPAC name

propan-2-yl 3-{3-amino-46-dimethylthieno[23-b]pyridine-2-amido}benzoate

SMILES

CC(C)OC(c1cccc(NC(c(sc2nc(C)cc(C)c22)c2N)=O)c1)=O

InChI

InChI=1S/C20H21N3O3S/c1-10(2)26-20(25)13-6-5-7-14(9-13)23-18(24)17-16(21)15-11(3)8-12(4)22-19(15)27-17/h5-10H,21H2,1-4H3,(H,23,24)

InChI Key

HYIXJTQVQDONCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05256476

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.316

Distribution Coefficient, logD

4.315

Water Solubility, LogSw

-4.66

Polar Surface Area

72.675

Acid Dissociation Constant (pKa)

12.48

Base Dissociation Constant (pKb)

3.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

7169-3749 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 7169-3749 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7169-3749?
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What is the minimum amount of 7169-3749 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7169-3749
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7169-3749
  • 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 7169-3749 available by request