6484-0087 Screening compound: 5-(4-ethylphenyl)-1-(3-methoxypropyl)-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione

6484-0087 Screening compound: 5-(4-ethylphenyl)-1-(3-methoxypropyl)-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
6484-0087 Screening compound: 5-(4-ethylphenyl)-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 6484-0087
5-(4-ethylphenyl)-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

6484-0087

Molecular Formula

C26H25N3O4 (C26 H25 N3 O4)

Compound Name

5-(4-ethylphenyl)-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-ethylphenyl)-7-(3-methoxypropyl)-579-triazatetracyclo[8.7.0.0^{38}.0^{1116}]heptadeca-1(10)3(8)111315-pentaene-4617-trione

SMILES

CCc1ccc(C(C(C(c2c3cccc2)=O)=C3N2)C(C(N3)=O)=C2N(CCCOC)C3=O)cc1

InChI

InChI=1S/C26H25N3O4/c1-3-15-9-11-16(12-10-15)19-20-22(17-7-4-5-8-18(17)23(20)30)27-24-21(19)25(31)28-26(32)29(24)13-6-14-33-2/h4-5,7-12,19,27H,3,6,13-14H2,1-2H3,(H,28,31,32)/t19-/m0/s1

InChI Key

UHYXGQJBKVPGAM-IBGZPJMESA-N

MDL Number (MFCD)

MFCD07180990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.737

Distribution Coefficient, logD

2.191

Water Solubility, LogSw

-3.97

Polar Surface Area

72.980

Acid Dissociation Constant (pKa)

5.87

Base Dissociation Constant (pKb)

-8.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.90

References: we are preparing a list of scientific research reports with 6484-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6484-0087?
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What is the minimum amount of 6484-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6484-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6484-0087
  • 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 6484-0087 available by request