C547-0811 Screening compound: N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]butanamide

C547-0811 Screening compound: N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]butanamide
C547-0811 Screening compound: N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C547-0811
N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]butanamide

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

C547-0811

Molecular Formula

C26H33N3O3 (C26 H33 N3 O3)

Compound Name

N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]butanamide

IUPAC name

N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-[(1-methyl-2-oxo-12-dihydroquinolin-4-yl)oxy]butanamide

SMILES

CCN(CCCNC(CCCOC(c(cccc1)c1N1C)=CC1=O)=O)c1cc(C)ccc1

InChI

InChI=1S/C26H33N3O3/c1-4-29(21-11-7-10-20(2)18-21)16-9-15-27-25(30)14-8-17-32-24-19-26(31)28(3)23-13-6-5-12-22(23)24/h5-7,10-13,18-19H,4,8-9,14-17H2,1-3H3,(H,27,30)

InChI Key

TUPYGTQMINXERY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14769221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.114

Distribution Coefficient, logD

3.082

Water Solubility, LogSw

-3.60

Polar Surface Area

49.796

Acid Dissociation Constant (pKa)

14.95

Base Dissociation Constant (pKb)

6.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with C547-0811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C547-0811?
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What is the minimum amount of C547-0811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C547-0811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C547-0811
  • 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 C547-0811 available by request