4664-3670 Screening compound: N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3,5-dimethylphenyl)-3,4-dimethoxybenzene-1-sulfonamide

4664-3670 Screening compound: N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3,5-dimethylphenyl)-3,4-dimethoxybenzene-1-sulfonamide
4664-3670 Screening compound: N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3,5-dimethylphenyl)-3,4-dimethoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4664-3670
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3,5-dimethylphenyl)-3,4-dimethoxybenzene-1-sulfonamide

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

4664-3670

Molecular Formula

C24H32N2O5S (C24 H32 N2 O5 S)

Compound Name

N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3,5-dimethylphenyl)-3,4-dimethoxybenzene-1-sulfonamide

IUPAC name

N-[2-(azepan-1-yl)-2-oxoethyl]-N-(35-dimethylphenyl)-34-dimethoxybenzene-1-sulfonamide

SMILES

Cc1cc(N(CC(N2CCCCCC2)=O)S(c(cc2)cc(OC)c2OC)(=O)=O)cc(C)c1

InChI

InChI=1S/C24H32N2O5S/c1-18-13-19(2)15-20(14-18)26(17-24(27)25-11-7-5-6-8-12-25)32(28,29)21-9-10-22(30-3)23(16-21)31-4/h9-10,13-16H,5-8,11-12,17H2,1-4H3

InChI Key

DCUBKDBKJCFJMU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02106795

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.093

Distribution Coefficient, logD

4.093

Water Solubility, LogSw

-4.22

Polar Surface Area

63.777

Acid Dissociation Constant (pKa)

20.71

Base Dissociation Constant (pKb)

5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.80

4664-3670 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 4664-3670 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4664-3670?
Check Price and Availability of 4664-3670, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4664-3670 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4664-3670
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4664-3670
  • 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 4664-3670 available by request