6484-0139 Screening compound: 5-(3-hydroxyphenyl)-1-methyl-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione

6484-0139 Screening compound: 5-(3-hydroxyphenyl)-1-methyl-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
6484-0139 Screening compound: 5-(3-hydroxyphenyl)-1-methyl-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 6484-0139
5-(3-hydroxyphenyl)-1-methyl-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione

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

6484-0139

Molecular Formula

C21H15N3O4 (C21 H15 N3 O4)

Compound Name

5-(3-hydroxyphenyl)-1-methyl-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione

IUPAC name

2-(3-hydroxyphenyl)-7-methyl-579-triazatetracyclo[8.7.0.0^{38}.0^{1116}]heptadeca-1(10)3(8)111315-pentaene-4617-trione

SMILES

CN(C(NC(c1c2cccc1)=C(C1c3cc(O)ccc3)C2=O)=C1C(N1)=O)C1=O

InChI

InChI=1S/C21H15N3O4/c1-24-19-16(20(27)23-21(24)28)14(10-5-4-6-11(25)9-10)15-17(22-19)12-7-2-3-8-13(12)18(15)26/h2-9,14,22,25H,1H3,(H,23,27,28)/t14-/m0/s1

InChI Key

HPFBNUWCPOTFKN-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD07181011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.912

Distribution Coefficient, logD

-0.073

Water Solubility, LogSw

-2.72

Polar Surface Area

82.042

Acid Dissociation Constant (pKa)

5.42

Base Dissociation Constant (pKb)

-9.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.50

6484-0139 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Nucleoside Mimetics Library (2197 compounds)

Antibacterial Compounds Library (13827 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
  • Infections
  • Immune system
  • animal
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 6484-0139 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6484-0139?
Check Price and Availability of 6484-0139, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6484-0139 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6484-0139
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6484-0139
  • 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 6484-0139 available by request