5282-0490 Screening compound: 2-imino-1-(3-morpholinopropyl)-5-oxo-N~3~-(1-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

5282-0490 Screening compound: 2-imino-1-(3-morpholinopropyl)-5-oxo-N~3~-(1-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
5282-0490 Screening compound: 2-imino-1-(3-morpholinopropyl)-5-oxo-N~3~-(1-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5282-0490
2-imino-1-(3-morpholinopropyl)-5-oxo-N~3~-(1-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

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

5282-0490

Molecular Formula

C27H30N6O3 (C27 H30 N6 O3)

Compound Name

2-imino-1-(3-morpholinopropyl)-5-oxo-N~3~-(1-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

IUPAC name

6-imino-7-[3-(morpholin-4-yl)propyl]-2-oxo-N-(1-phenylethyl)-179-triazatricyclo[8.4.0.0^{38}]tetradeca-3(8)491113-pentaene-5-carboxamide

SMILES

CC(c1ccccc1)NC(C(C(N1CCCN2CCOCC2)=N)=CC2=C1N=C(C=CC=C1)N1C2=O)=O

InChI

InChI=1S/C27H30N6O3/c1-19(20-8-3-2-4-9-20)29-26(34)21-18-22-25(30-23-10-5-6-12-32(23)27(22)35)33(24(21)28)13-7-11-31-14-16-36-17-15-31/h2-6,8-10,12,18-19,28H,7,11,13-17H2,1H3,(H,29,34)/t19-/m0/s1

InChI Key

ZOALHSBJALBQRP-IBGZPJMESA-N

MDL Number (MFCD)

MFCD03509858

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.472

Distribution Coefficient, logD

1.357

Water Solubility, LogSw

-1.80

Polar Surface Area

79.715

Acid Dissociation Constant (pKa)

8.32

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

5282-0490 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PI3K-Targeted Library (17255 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 5282-0490 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5282-0490?
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What is the minimum amount of 5282-0490 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5282-0490
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5282-0490
  • 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 5282-0490 available by request