F394-0488 Screening compound: N-(3-fluorophenyl)-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-5-yl}acetamide

F394-0488 Screening compound: N-(3-fluorophenyl)-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-5-yl}acetamide
F394-0488 Screening compound: N-(3-fluorophenyl)-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-5-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F394-0488
N-(3-fluorophenyl)-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-5-yl}acetamide

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

F394-0488

Molecular Formula

C27H23FN4O3 (C27 H23 FN4 O3)

Compound Name

N-(3-fluorophenyl)-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-5-yl}acetamide

IUPAC name

N-(3-fluorophenyl)-2-{3-[(4-methoxyphenyl)methyl]-8-methyl-4-oxo-3H4H5H-pyrimido[54-b]indol-5-yl}acetamide

SMILES

Cc(cc1)cc2c1n(CC(Nc1cccc(F)c1)=O)c1c2N=CN(Cc(cc2)ccc2OC)C1=O

InChI

InChI=1S/C27H23FN4O3/c1-17-6-11-23-22(12-17)25-26(32(23)15-24(33)30-20-5-3-4-19(28)13-20)27(34)31(16-29-25)14-18-7-9-21(35-2)10-8-18/h3-13,16H,14-15H2,1-2H3,(H,30,33)

InChI Key

ZUEYJKYNBAGXTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27122599

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.662

Distribution Coefficient, logD

4.662

Water Solubility, LogSw

-4.49

Polar Surface Area

55.622

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

-0.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

References: we are preparing a list of scientific research reports with F394-0488 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F394-0488?
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What is the minimum amount of F394-0488 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F394-0488
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F394-0488
  • 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 F394-0488 available by request