C382-0251 Screening compound: 4-(benzenesulfonamidomethyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide

C382-0251 Screening compound: 4-(benzenesulfonamidomethyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide
C382-0251 Screening compound: 4-(benzenesulfonamidomethyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C382-0251
4-(benzenesulfonamidomethyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide

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

C382-0251

Molecular Formula

C22H20N2O5S (C22 H20 N2 O5 S)

Compound Name

4-(benzenesulfonamidomethyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide

IUPAC name

4-(benzenesulfonamidomethyl)-N-[(2H-13-benzodioxol-5-yl)methyl]benzamide

SMILES

O=C(c1ccc(CNS(c2ccccc2)(=O)=O)cc1)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C22H20N2O5S/c25-22(23-13-17-8-11-20-21(12-17)29-15-28-20)18-9-6-16(7-10-18)14-24-30(26,27)19-4-2-1-3-5-19/h1-12,24H,13-15H2,(H,23,25)

InChI Key

NASWOAOYVKZFKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14754932

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.119

Distribution Coefficient, logD

3.119

Water Solubility, LogSw

-3.45

Polar Surface Area

83.526

Acid Dissociation Constant (pKa)

10.66

Base Dissociation Constant (pKb)

-3.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

C382-0251 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C382-0251 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C382-0251?
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What is the minimum amount of C382-0251 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C382-0251
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C382-0251
  • 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 C382-0251 available by request