D207-0109 Screening compound: N1-[(3,4-dimethoxyphenyl)methyl]-N4,N4-diethyl-N1-(2-methylcyclohexyl)benzene-1,4-disulfonamide

D207-0109 Screening compound: N1-[(3,4-dimethoxyphenyl)methyl]-N4,N4-diethyl-N1-(2-methylcyclohexyl)benzene-1,4-disulfonamide
D207-0109 Screening compound: N1-[(3,4-dimethoxyphenyl)methyl]-N4,N4-diethyl-N1-(2-methylcyclohexyl)benzene-1,4-disulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D207-0109
N1-[(3,4-dimethoxyphenyl)methyl]-N4,N4-diethyl-N1-(2-methylcyclohexyl)benzene-1,4-disulfonamide

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

D207-0109

Molecular Formula

C26H38N2O6S2 (C26 H38 N2 O6 S2)

Compound Name

N1-[(3,4-dimethoxyphenyl)methyl]-N4,N4-diethyl-N1-(2-methylcyclohexyl)benzene-1,4-disulfonamide

IUPAC name

N1-[(34-dimethoxyphenyl)methyl]-N4N4-diethyl-N1-(2-methylcyclohexyl)benzene-14-disulfonamide

SMILES

CCN(CC)S(c(cc1)ccc1S(N(Cc(cc1)cc(OC)c1OC)C1C(C)CCCC1)(=O)=O)(=O)=O

InChI

InChI=1S/C26H38N2O6S2/c1-6-27(7-2)35(29,30)22-13-15-23(16-14-22)36(31,32)28(24-11-9-8-10-20(24)3)19-21-12-17-25(33-4)26(18-21)34-5/h12-18,20,24H,6-11,19H2,1-5H3

InChI Key

WXVNWAPVQCABGD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03736992

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

538.73

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.338

Distribution Coefficient, logD

4.338

Water Solubility, LogSw

-4.33

Polar Surface Area

77.448

Acid Dissociation Constant (pKa)

25.14

Base Dissociation Constant (pKb)

-4.04

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

53.80

D207-0109 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D207-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D207-0109?
Check Price and Availability of D207-0109, 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 D207-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D207-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D207-0109
  • 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 D207-0109 available by request