N124-0032 Screening compound: 8-hydroxy-7-(hydroxymethyl)-N-(3-phenylpropyl)-5-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxole-6-carboxamide

N124-0032 Screening compound: 8-hydroxy-7-(hydroxymethyl)-N-(3-phenylpropyl)-5-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxole-6-carboxamide
N124-0032 Screening compound: 8-hydroxy-7-(hydroxymethyl)-N-(3-phenylpropyl)-5-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound N124-0032
8-hydroxy-7-(hydroxymethyl)-N-(3-phenylpropyl)-5-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxole-6-carboxamide

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

N124-0032

Molecular Formula

C31H35NO8 (C31 H35 NO8)

Compound Name

8-hydroxy-7-(hydroxymethyl)-N-(3-phenylpropyl)-5-(3,4,5-trimethoxyphenyl)-2H,5H,6H,7H,8H-naphtho[2,3-d][1,3]dioxole-6-carboxamide

IUPAC name

(5R6R7R8R)-8-hydroxy-7-(hydroxymethyl)-N-(3-phenylpropyl)-5-(345-trimethoxyphenyl)-2H5H6H7H8H-naphtho[23-d][13]dioxole-6-carboxamide

SMILES

COc1cc([C@@H]([C@H]([C@H](CO)[C@H]2O)C(NCCCc3ccccc3)=O)c3c2cc2OCOc2c3)cc(OC)c1OC

InChI

InChI=1S/C31H35NO8/c1-36-25-12-19(13-26(37-2)30(25)38-3)27-20-14-23-24(40-17-39-23)15-21(20)29(34)22(16-33)28(27)31(35)32-11-7-10-18-8-5-4-6-9-18/h4-6,8-9,12-15,22,27-29,33-34H,7,10-11,16-17H2,1-3H3,(H,32,35)/t22-,27+,28-,29+/m0/s1

InChI Key

SQIZIKVMNGFZJM-ALMBTRMVSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

549.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.343

Distribution Coefficient, logD

3.343

Water Solubility, LogSw

-3.49

Polar Surface Area

96.860

Acid Dissociation Constant (pKa)

12.13

Base Dissociation Constant (pKb)

-1.18

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

38.71

N124-0032 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 N124-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N124-0032?
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What is the minimum amount of N124-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N124-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N124-0032
  • 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 N124-0032 available by request