M124-0177 Screening compound: methyl 2-(azepan-1-yl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxylate

M124-0177 Screening compound: methyl 2-(azepan-1-yl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxylate
M124-0177 Screening compound: methyl 2-(azepan-1-yl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound M124-0177
methyl 2-(azepan-1-yl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxylate

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

M124-0177

Molecular Formula

C24H27N3O3 (C24 H27 N3 O3)

Compound Name

methyl 2-(azepan-1-yl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxylate

IUPAC name

methyl 2-(azepan-1-yl)-4-oxo-3-(2-phenylethyl)-34-dihydroquinazoline-7-carboxylate

SMILES

COC(c(cc1)cc(N=C(N2CCc3ccccc3)N3CCCCCC3)c1C2=O)=O

InChI

InChI=1S/C24H27N3O3/c1-30-23(29)19-11-12-20-21(17-19)25-24(26-14-7-2-3-8-15-26)27(22(20)28)16-13-18-9-5-4-6-10-18/h4-6,9-12,17H,2-3,7-8,13-16H2,1H3

InChI Key

SLVZZLJEAYOLKR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27498247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.458

Distribution Coefficient, logD

4.458

Water Solubility, LogSw

-4.35

Polar Surface Area

50.306

Acid Dissociation Constant (pKa)

26.28

Base Dissociation Constant (pKb)

0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

M124-0177 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • GPCR
  • Proteases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M124-0177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M124-0177?
Check Price and Availability of M124-0177, 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 M124-0177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M124-0177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M124-0177
  • 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 M124-0177 available by request