Y070-3263 Screening compound: 2-imino-N~3~-(3-methoxyphenyl)-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

Y070-3263 Screening compound: 2-imino-N~3~-(3-methoxyphenyl)-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
Y070-3263 Screening compound: 2-imino-N~3~-(3-methoxyphenyl)-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-3263
2-imino-N~3~-(3-methoxyphenyl)-1-octyl-5-oxo-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

Y070-3263

Molecular Formula

C27H31N5O3 (C27 H31 N5 O3)

Compound Name

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

IUPAC name

6-imino-N-(3-methoxyphenyl)-7-octyl-2-oxo-179-triazatricyclo[8.4.0.0^{38}]tetradeca-3(8)491113-pentaene-5-carboxamide

SMILES

CCCCCCCCN(C(C(C(Nc1cc(OC)ccc1)=O)=C1)=N)C(N=C2N3C=CC=C2)=C1C3=O

InChI

InChI=1S/C27H31N5O3/c1-3-4-5-6-7-9-16-32-24(28)21(26(33)29-19-12-11-13-20(17-19)35-2)18-22-25(32)30-23-14-8-10-15-31(23)27(22)34/h8,10-15,17-18,28H,3-7,9,16H2,1-2H3,(H,29,33)

InChI Key

LVASGXUYDARCPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18076277

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.050

Distribution Coefficient, logD

4.415

Water Solubility, LogSw

-4.71

Polar Surface Area

75.154

Acid Dissociation Constant (pKa)

8.11

Base Dissociation Constant (pKb)

5.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

Y070-3263 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with Y070-3263 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-3263?
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What is the minimum amount of Y070-3263 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-3263
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-3263
  • 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 Y070-3263 available by request