6484-0030 Screening compound: 1-methyl-5-(2-methylphenyl)-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione

6484-0030 Screening compound: 1-methyl-5-(2-methylphenyl)-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
6484-0030 Screening compound: 1-methyl-5-(2-methylphenyl)-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 6484-0030
1-methyl-5-(2-methylphenyl)-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

6484-0030

Molecular Formula

C22H17N3O3 (C22 H17 N3 O3)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(C(C(C(c2c3cccc2)=O)=C3N2)C(C(N3)=O)=C2N(C)C3=O)cccc1

InChI

InChI=1S/C22H17N3O3/c1-11-7-3-4-8-12(11)15-16-18(13-9-5-6-10-14(13)19(16)26)23-20-17(15)21(27)24-22(28)25(20)2/h3-10,15,23H,1-2H3,(H,24,27,28)/t15-/m0/s1

InChI Key

OJBGFAULIXBWFV-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD07180962

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.956

Distribution Coefficient, logD

0.972

Water Solubility, LogSw

-3.73

Polar Surface Area

64.425

Acid Dissociation Constant (pKa)

5.42

Base Dissociation Constant (pKb)

-10.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.60

6484-0030 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 6484-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6484-0030?
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What is the minimum amount of 6484-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6484-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6484-0030
  • 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 6484-0030 available by request