K407-0610 Screening compound: 1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinolin-2-yl}-2-phenylbutan-1-one

K407-0610 Screening compound: 1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinolin-2-yl}-2-phenylbutan-1-one
K407-0610 Screening compound: 1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinolin-2-yl}-2-phenylbutan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K407-0610
1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinolin-2-yl}-2-phenylbutan-1-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

K407-0610

Molecular Formula

C29H33NO5 (C29 H33 NO5)

Compound Name

1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinolin-2-yl}-2-phenylbutan-1-one

IUPAC name

1-{67-dimethoxy-1-[(4-methoxyphenoxy)methyl]-1234-tetrahydroisoquinolin-2-yl}-2-phenylbutan-1-one

SMILES

CCC(C(N(CC1)C(COc(cc2)ccc2OC)c(cc2OC)c1cc2OC)=O)c1ccccc1

InChI

InChI=1S/C29H33NO5/c1-5-24(20-9-7-6-8-10-20)29(31)30-16-15-21-17-27(33-3)28(34-4)18-25(21)26(30)19-35-23-13-11-22(32-2)12-14-23/h6-14,17-18,24,26H,5,15-16,19H2,1-4H3

InChI Key

MKCQZUWOCZBNRY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04411899

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.108

Distribution Coefficient, logD

5.108

Water Solubility, LogSw

-5.05

Polar Surface Area

46.117

Acid Dissociation Constant (pKa)

18.48

Base Dissociation Constant (pKb)

-0.90

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

34.50

K407-0610 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K407-0610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K407-0610?
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What is the minimum amount of K407-0610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K407-0610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K407-0610
  • 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 K407-0610 available by request