M402-0031 Screening compound: 3-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-2-(piperidin-1-yl)-3,4-dihydroquinazolin-4-one

M402-0031 Screening compound: 3-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-2-(piperidin-1-yl)-3,4-dihydroquinazolin-4-one
M402-0031 Screening compound: 3-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-2-(piperidin-1-yl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M402-0031
3-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-2-(piperidin-1-yl)-3,4-dihydroquinazolin-4-one

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

M402-0031

Molecular Formula

C26H30ClN5O2 (C26 H30 ClN5 O2)

Compound Name

3-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-2-(piperidin-1-yl)-3,4-dihydroquinazolin-4-one

IUPAC name

3-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-2-(piperidin-1-yl)-34-dihydroquinazolin-4-one

SMILES

O=C(CCN1C(N2CCCCC2)=Nc(cccc2)c2C1=O)N(CC1)CCN1c1cccc(Cl)c1

InChI

InChI=1S/C26H30ClN5O2/c27-20-7-6-8-21(19-20)29-15-17-30(18-16-29)24(33)11-14-32-25(34)22-9-2-3-10-23(22)28-26(32)31-12-4-1-5-13-31/h2-3,6-10,19H,1,4-5,11-18H2

InChI Key

MZFJADVSYVPPSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27540015

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.01

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.379

Distribution Coefficient, logD

3.379

Water Solubility, LogSw

-3.83

Polar Surface Area

48.454

Acid Dissociation Constant (pKa)

23.94

Base Dissociation Constant (pKb)

2.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

M402-0031 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases

References: we are preparing a list of scientific research reports with M402-0031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M402-0031?
Check Price and Availability of M402-0031, 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 M402-0031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M402-0031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M402-0031
  • 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 M402-0031 available by request