C191-0323 Screening compound: 6,7-dimethoxy-3-[6-oxo-6-(1,2,3,4-tetrahydroisoquinolin-2-yl)hexyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

C191-0323 Screening compound: 6,7-dimethoxy-3-[6-oxo-6-(1,2,3,4-tetrahydroisoquinolin-2-yl)hexyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione
C191-0323 Screening compound: 6,7-dimethoxy-3-[6-oxo-6-(1,2,3,4-tetrahydroisoquinolin-2-yl)hexyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C191-0323
6,7-dimethoxy-3-[6-oxo-6-(1,2,3,4-tetrahydroisoquinolin-2-yl)hexyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

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

C191-0323

Molecular Formula

C25H29N3O5 (C25 H29 N3 O5)

Compound Name

6,7-dimethoxy-3-[6-oxo-6-(1,2,3,4-tetrahydroisoquinolin-2-yl)hexyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

IUPAC name

67-dimethoxy-3-[6-oxo-6-(1234-tetrahydroisoquinolin-2-yl)hexyl]-1234-tetrahydroquinazoline-24-dione

SMILES

COc(c(OC)c1)cc(C(N2CCCCCC(N(CC3)Cc4c3cccc4)=O)=O)c1NC2=O

InChI

InChI=1S/C25H29N3O5/c1-32-21-14-19-20(15-22(21)33-2)26-25(31)28(24(19)30)12-7-3-4-10-23(29)27-13-11-17-8-5-6-9-18(17)16-27/h5-6,8-9,14-15H,3-4,7,10-13,16H2,1-2H3,(H,26,31)

InChI Key

VONMSMLPPCOUEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14725084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.236

Distribution Coefficient, logD

3.220

Water Solubility, LogSw

-3.47

Polar Surface Area

71.774

Acid Dissociation Constant (pKa)

8.82

Base Dissociation Constant (pKb)

-2.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with C191-0323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C191-0323?
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What is the minimum amount of C191-0323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C191-0323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C191-0323
  • 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 C191-0323 available by request