M059-1701 Screening compound: [2-(4-benzylpiperidino)-4,5-dihydro-1H-imidazol-1-yl](3,4,5-trimethoxyphenyl)methanone

M059-1701 Screening compound: [2-(4-benzylpiperidino)-4,5-dihydro-1H-imidazol-1-yl](3,4,5-trimethoxyphenyl)methanone
M059-1701 Screening compound: [2-(4-benzylpiperidino)-4,5-dihydro-1H-imidazol-1-yl](3,4,5-trimethoxyphenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound M059-1701
[2-(4-benzylpiperidino)-4,5-dihydro-1H-imidazol-1-yl](3,4,5-trimethoxyphenyl)methanone

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

M059-1701

Molecular Formula

C25H31N3O4 (C25 H31 N3 O4)

Compound Name

[2-(4-benzylpiperidino)-4,5-dihydro-1H-imidazol-1-yl](3,4,5-trimethoxyphenyl)methanone

IUPAC name

n/a

SMILES

COc1cc(C(N2C(N3CCC(Cc4ccccc4)CC3)=NCC2)=O)cc(OC)c1OC

InChI

InChI=1S/C25H31N3O4/c1-30-21-16-20(17-22(31-2)23(21)32-3)24(29)28-14-11-26-25(28)27-12-9-19(10-13-27)15-18-7-5-4-6-8-18/h4-8,16-17,19H,9-15H2,1-3H3

InChI Key

XMVOFMTUKOZSLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27495047

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.053

Distribution Coefficient, logD

4.048

Water Solubility, LogSw

-4.28

Polar Surface Area

52.600

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

5.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

M059-1701 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with M059-1701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M059-1701?
Check Price and Availability of M059-1701, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M059-1701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M059-1701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M059-1701
  • 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 M059-1701 available by request