2641-1588 Screening compound: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-phenyl-1H,2H,3H,4H,5H,6H-benzo[a]phenanthridin-4-one

2641-1588 Screening compound: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-phenyl-1H,2H,3H,4H,5H,6H-benzo[a]phenanthridin-4-one
2641-1588 Screening compound: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-phenyl-1H,2H,3H,4H,5H,6H-benzo[a]phenanthridin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2641-1588
5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-phenyl-1H,2H,3H,4H,5H,6H-benzo[a]phenanthridin-4-one

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

2641-1588

Molecular Formula

C30H24BrNO3 (C30 H24 BrNO3)

Compound Name

5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-phenyl-1H,2H,3H,4H,5H,6H-benzo[a]phenanthridin-4-one

IUPAC name

5-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-phenyl-1H2H3H4H5H6H-benzo[a]phenanthridin-4-one

SMILES

COc1cc(C(C(C(C2)=O)=C3CC2c2ccccc2)Nc2c3c3ccccc3cc2)cc(Br)c1O

InChI

InChI=1S/C30H24BrNO3/c1-35-26-16-20(14-23(31)30(26)34)29-28-22(13-19(15-25(28)33)17-7-3-2-4-8-17)27-21-10-6-5-9-18(21)11-12-24(27)32-29/h2-12,14,16,19,29,32,34H,13,15H2,1H3

InChI Key

GWZIUTNHKDLYIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01932492

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

526.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.744

Distribution Coefficient, logD

6.703

Water Solubility, LogSw

-6.67

Polar Surface Area

47.770

Acid Dissociation Constant (pKa)

8.40

Base Dissociation Constant (pKb)

-2.39

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 2641-1588 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2641-1588?
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What is the minimum amount of 2641-1588 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2641-1588
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2641-1588
  • 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 2641-1588 available by request