6484-0076 Screening compound: 5-(4-methoxyphenyl)-1-(3-methoxypropyl)-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione

6484-0076 Screening compound: 5-(4-methoxyphenyl)-1-(3-methoxypropyl)-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
6484-0076 Screening compound: 5-(4-methoxyphenyl)-1-(3-methoxypropyl)-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 6484-0076
5-(4-methoxyphenyl)-1-(3-methoxypropyl)-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

6484-0076

Molecular Formula

C25H23N3O5 (C25 H23 N3 O5)

Compound Name

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

IUPAC name

2-(4-methoxyphenyl)-7-(3-methoxypropyl)-579-triazatetracyclo[8.7.0.0^{38}.0^{1116}]heptadeca-1(10)3(8)111315-pentaene-4617-trione

SMILES

COCCCN(C(NC(c1c2cccc1)=C(C1c(cc3)ccc3OC)C2=O)=C1C(N1)=O)C1=O

InChI

InChI=1S/C25H23N3O5/c1-32-13-5-12-28-23-20(24(30)27-25(28)31)18(14-8-10-15(33-2)11-9-14)19-21(26-23)16-6-3-4-7-17(16)22(19)29/h3-4,6-11,18,26H,5,12-13H2,1-2H3,(H,27,30,31)/t18-/m0/s1

InChI Key

QDWGJSNFBQRSHO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD07180986

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.788

Distribution Coefficient, logD

1.243

Water Solubility, LogSw

-3.70

Polar Surface Area

80.523

Acid Dissociation Constant (pKa)

5.87

Base Dissociation Constant (pKb)

-8.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with 6484-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6484-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6484-0076
  • 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 6484-0076 available by request