E910-0090 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-3-[3-(4-fluorophenyl)-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl]propanamide

E910-0090 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-3-[3-(4-fluorophenyl)-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl]propanamide
E910-0090 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-3-[3-(4-fluorophenyl)-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E910-0090
N-{3-[benzyl(methyl)amino]propyl}-3-[3-(4-fluorophenyl)-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl]propanamide

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

E910-0090

Molecular Formula

C25H26FN5O3 (C25 H26 FN5 O3)

Compound Name

N-{3-[benzyl(methyl)amino]propyl}-3-[3-(4-fluorophenyl)-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl]propanamide

IUPAC name

N-{3-[benzyl(methyl)amino]propyl}-3-[3-(4-fluorophenyl)-4-oxo-4H5H-[12]oxazolo[54-d]pyrimidin-5-yl]propanamide

SMILES

CN(CCCNC(CCN(C=Nc1c2c(-c(cc3)ccc3F)no1)C2=O)=O)Cc1ccccc1

InChI

InChI=1S/C25H26FN5O3/c1-30(16-18-6-3-2-4-7-18)14-5-13-27-21(32)12-15-31-17-28-24-22(25(31)33)23(29-34-24)19-8-10-20(26)11-9-19/h2-4,6-11,17H,5,12-16H2,1H3,(H,27,32)

InChI Key

UNQBTADPBVNCCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14927138

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.838

Distribution Coefficient, logD

0.341

Water Solubility, LogSw

-2.30

Polar Surface Area

76.087

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

8.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

E910-0090 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Agro:
  • Agro
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with E910-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E910-0090?
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What is the minimum amount of E910-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E910-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E910-0090
  • 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 E910-0090 available by request