C387-0187 Screening compound: 2-[(4-methoxyphenyl)amino]-N-[3-(3-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide

C387-0187 Screening compound: 2-[(4-methoxyphenyl)amino]-N-[3-(3-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide
C387-0187 Screening compound: 2-[(4-methoxyphenyl)amino]-N-[3-(3-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C387-0187
2-[(4-methoxyphenyl)amino]-N-[3-(3-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide

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

C387-0187

Molecular Formula

C26H32N4O2 (C26 H32 N4 O2)

Compound Name

2-[(4-methoxyphenyl)amino]-N-[3-(3-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide

IUPAC name

2-[(4-methoxyphenyl)amino]-N-[3-(3-methylpiperidin-1-yl)propyl]quinoline-4-carboxamide

SMILES

CC1CN(CCCNC(c2cc(Nc(cc3)ccc3OC)nc3ccccc23)=O)CCC1

InChI

InChI=1S/C26H32N4O2/c1-19-7-5-15-30(18-19)16-6-14-27-26(31)23-17-25(29-24-9-4-3-8-22(23)24)28-20-10-12-21(32-2)13-11-20/h3-4,8-13,17,19H,5-7,14-16,18H2,1-2H3,(H,27,31)(H,28,29)/t19-/m0/s1

InChI Key

HLFXOMYLALKMHF-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14755315

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.935

Distribution Coefficient, logD

2.364

Water Solubility, LogSw

-4.71

Polar Surface Area

53.763

Acid Dissociation Constant (pKa)

16.08

Base Dissociation Constant (pKb)

9.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

C387-0187 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with C387-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C387-0187?
Check Price and Availability of C387-0187, 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 C387-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C387-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C387-0187
  • 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 C387-0187 available by request