F463-0491 Screening compound: 1-(7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-N~4~-(3-pyridylmethyl)-4-piperidinecarboxamide

F463-0491 Screening compound: 1-(7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-N~4~-(3-pyridylmethyl)-4-piperidinecarboxamide
F463-0491 Screening compound: 1-(7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-N~4~-(3-pyridylmethyl)-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F463-0491
1-(7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-N~4~-(3-pyridylmethyl)-4-piperidinecarboxamide

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

F463-0491

Molecular Formula

C23H24N6OS (C23 H24 N6 OS)

Compound Name

1-(7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)-N~4~-(3-pyridylmethyl)-4-piperidinecarboxamide

IUPAC name

1-{1113-dimethyl-8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-6-yl}-N-[(pyridin-3-yl)methyl]piperidine-4-carboxamide

SMILES

Cc1c(c2ncnc(N(CC3)CCC3C(NCc3cnccc3)=O)c2s2)c2nc(C)c1

InChI

InChI=1S/C23H24N6OS/c1-14-10-15(2)28-23-18(14)19-20(31-23)21(27-13-26-19)29-8-5-17(6-9-29)22(30)25-12-16-4-3-7-24-11-16/h3-4,7,10-11,13,17H,5-6,8-9,12H2,1-2H3,(H,25,30)

InChI Key

MXAQKBKXRHCIOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14955351

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.052

Distribution Coefficient, logD

3.005

Water Solubility, LogSw

-2.99

Polar Surface Area

67.377

Acid Dissociation Constant (pKa)

13.36

Base Dissociation Constant (pKb)

6.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

F463-0491 in Drug Discovery

Included in Screening Libraries

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

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with F463-0491 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F463-0491?
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What is the minimum amount of F463-0491 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F463-0491
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F463-0491
  • 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 F463-0491 available by request