F081-0890 Screening compound: N-(1-methyl-2-phenylethyl)-N-(2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)amine

F081-0890 Screening compound: N-(1-methyl-2-phenylethyl)-N-(2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)amine
F081-0890 Screening compound: N-(1-methyl-2-phenylethyl)-N-(2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound F081-0890
N-(1-methyl-2-phenylethyl)-N-(2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)amine

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

F081-0890

Molecular Formula

C24H26N4OS (C24 H26 N4 OS)

Compound Name

N-(1-methyl-2-phenylethyl)-N-(2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)amine

IUPAC name

5513-trimethyl-N-(1-phenylpropan-2-yl)-6-oxa-17-thia-21214-triazatetracyclo[8.7.0.0^{38}.0^{1116}]heptadeca-13(8)911(16)1214-hexaen-15-amine

SMILES

CC(Cc1ccccc1)Nc1c2sc3nc(CC(C)(C)OC4)c4cc3c2nc(C)n1

InChI

InChI=1S/C24H26N4OS/c1-14(10-16-8-6-5-7-9-16)25-22-21-20(26-15(2)27-22)18-11-17-13-29-24(3,4)12-19(17)28-23(18)30-21/h5-9,11,14H,10,12-13H2,1-4H3,(H,25,26,27)/t14-/m0/s1

InChI Key

BMFIKSXBIPTDIP-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD03302803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.770

Distribution Coefficient, logD

5.571

Water Solubility, LogSw

-5.63

Polar Surface Area

48.062

Acid Dissociation Constant (pKa)

17.76

Base Dissociation Constant (pKb)

7.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

F081-0890 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F081-0890 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F081-0890?
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What is the minimum amount of F081-0890 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F081-0890
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F081-0890
  • 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 F081-0890 available by request