8018-8917 Screening compound: 2-[(1E)-2-(2,4-dichlorophenyl)ethenyl]-N-[5-(diethylamino)pentan-2-yl]-6-methoxyquinazolin-4-amine

8018-8917 Screening compound: 2-[(1E)-2-(2,4-dichlorophenyl)ethenyl]-N-[5-(diethylamino)pentan-2-yl]-6-methoxyquinazolin-4-amine
8018-8917 Screening compound: 2-[(1E)-2-(2,4-dichlorophenyl)ethenyl]-N-[5-(diethylamino)pentan-2-yl]-6-methoxyquinazolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8917
2-[(1E)-2-(2,4-dichlorophenyl)ethenyl]-N-[5-(diethylamino)pentan-2-yl]-6-methoxyquinazolin-4-amine

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

8018-8917

Molecular Formula

C26H32Cl2N4O (C26 H32 Cl2 N4 O)

Compound Name

2-[(1E)-2-(2,4-dichlorophenyl)ethenyl]-N-[5-(diethylamino)pentan-2-yl]-6-methoxyquinazolin-4-amine

IUPAC name

2-[(1E)-2-(24-dichlorophenyl)ethenyl]-N-[5-(diethylamino)pentan-2-yl]-6-methoxyquinazolin-4-amine

SMILES

CCN(CC)CCCC(C)Nc(c1c2)nc(/C=C/c(ccc(Cl)c3)c3Cl)nc1ccc2OC

InChI

InChI=1S/C26H32Cl2N4O/c1-5-32(6-2)15-7-8-18(3)29-26-22-17-21(33-4)12-13-24(22)30-25(31-26)14-10-19-9-11-20(27)16-23(19)28/h9-14,16-18H,5-8,15H2,1-4H3,(H,29,30,31)/t18-/m0/s1

InChI Key

OFUVJTUTXSSQIJ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD01709354

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

487.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.256

Distribution Coefficient, logD

4.201

Water Solubility, LogSw

-6.63

Polar Surface Area

40.786

Acid Dissociation Constant (pKa)

18.91

Base Dissociation Constant (pKb)

10.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

8018-8917 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • GPCR
  • Ion Channels
  • Phosphatases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-8917 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8917?
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What is the minimum amount of 8018-8917 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8917
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8917
  • 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 8018-8917 available by request