N124-0101 Screening compound: 6-(hydroxymethyl)-7-(4-phenylpiperazine-1-carbonyl)-8-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxol-5-ol

N124-0101 Screening compound: 6-(hydroxymethyl)-7-(4-phenylpiperazine-1-carbonyl)-8-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxol-5-ol
N124-0101 Screening compound: 6-(hydroxymethyl)-7-(4-phenylpiperazine-1-carbonyl)-8-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxol-5-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound N124-0101
6-(hydroxymethyl)-7-(4-phenylpiperazine-1-carbonyl)-8-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxol-5-ol

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

N124-0101

Molecular Formula

C32H36N2O8 (C32 H36 N2 O8)

Compound Name

6-(hydroxymethyl)-7-(4-phenylpiperazine-1-carbonyl)-8-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxol-5-ol

IUPAC name

(5R6R7R8R)-6-(hydroxymethyl)-7-(4-phenylpiperazine-1-carbonyl)-8-(345-trimethoxyphenyl)-2H5H6H7H8H-naphtho[23-d][13]dioxol-5-ol

SMILES

COc1cc([C@@H]([C@H]([C@H](CO)[C@H]2O)C(N(CC3)CCN3c3ccccc3)=O)c3c2cc2OCOc2c3)cc(OC)c1OC

InChI

InChI=1S/C32H36N2O8/c1-38-26-13-19(14-27(39-2)31(26)40-3)28-21-15-24-25(42-18-41-24)16-22(21)30(36)23(17-35)29(28)32(37)34-11-9-33(10-12-34)20-7-5-4-6-8-20/h4-8,13-16,23,28-30,35-36H,9-12,17-18H2,1-3H3/t23-,28+,29-,30+/m0/s1

InChI Key

QZVKGFMTUBTFHP-VQCLQPKNSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

576.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.674

Distribution Coefficient, logD

2.674

Water Solubility, LogSw

-3.11

Polar Surface Area

92.514

Acid Dissociation Constant (pKa)

14.94

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

40.63

N124-0101 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Natural-Product-Based Library (3730 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Structure:
  • Pool

References: we are preparing a list of scientific research reports with N124-0101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N124-0101?
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What is the minimum amount of N124-0101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N124-0101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N124-0101
  • 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 N124-0101 available by request