K407-0347 Screening compound: 6,7-dimethoxy-2-(4-methylbenzoyl)-1-[(4-nitrophenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline

K407-0347 Screening compound: 6,7-dimethoxy-2-(4-methylbenzoyl)-1-[(4-nitrophenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline
K407-0347 Screening compound: 6,7-dimethoxy-2-(4-methylbenzoyl)-1-[(4-nitrophenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound K407-0347
6,7-dimethoxy-2-(4-methylbenzoyl)-1-[(4-nitrophenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline

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

K407-0347

Molecular Formula

C26H26N2O6 (C26 H26 N2 O6)

Compound Name

6,7-dimethoxy-2-(4-methylbenzoyl)-1-[(4-nitrophenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline

IUPAC name

67-dimethoxy-2-(4-methylbenzoyl)-1-[(4-nitrophenoxy)methyl]-1234-tetrahydroisoquinoline

SMILES

Cc(cc1)ccc1C(N(CC1)C(COc(cc2)ccc2[N+]([O-])=O)c(cc2OC)c1cc2OC)=O

InChI

InChI=1S/C26H26N2O6/c1-17-4-6-18(7-5-17)26(29)27-13-12-19-14-24(32-2)25(33-3)15-22(19)23(27)16-34-21-10-8-20(9-11-21)28(30)31/h4-11,14-15,23H,12-13,16H2,1-3H3/t23-/m0/s1

InChI Key

MWHUZCVKGUTOEP-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD04412144

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.522

Distribution Coefficient, logD

4.522

Water Solubility, LogSw

-4.32

Polar Surface Area

71.955

Acid Dissociation Constant (pKa)

22.43

Base Dissociation Constant (pKb)

-3.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.90

References: we are preparing a list of scientific research reports with K407-0347 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K407-0347?
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What is the minimum amount of K407-0347 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K407-0347
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K407-0347
  • 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 K407-0347 available by request