C274-3467 Screening compound: 4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(3,4-dimethoxyphenyl)cyclohexane-1-carboxamide

C274-3467 Screening compound: 4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(3,4-dimethoxyphenyl)cyclohexane-1-carboxamide
C274-3467 Screening compound: 4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(3,4-dimethoxyphenyl)cyclohexane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C274-3467
4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(3,4-dimethoxyphenyl)cyclohexane-1-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

C274-3467

Molecular Formula

C20H25BrN2O5S2 (C20 H25 BrN2 O5 S2)

Compound Name

4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(3,4-dimethoxyphenyl)cyclohexane-1-carboxamide

IUPAC name

4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(34-dimethoxyphenyl)cyclohexane-1-carboxamide

SMILES

COc(ccc(NC(C1CCC(CNS(c(s2)ccc2Br)(=O)=O)CC1)=O)c1)c1OC

InChI

InChI=1S/C20H25BrN2O5S2/c1-27-16-8-7-15(11-17(16)28-2)23-20(24)14-5-3-13(4-6-14)12-22-30(25,26)19-10-9-18(21)29-19/h7-11,13-14,22H,3-6,12H2,1-2H3,(H,23,24)

InChI Key

UBZJPKRWCJOTFL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14740329

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

517.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.076

Distribution Coefficient, logD

4.076

Water Solubility, LogSw

-4.28

Polar Surface Area

81.559

Acid Dissociation Constant (pKa)

10.77

Base Dissociation Constant (pKb)

2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

C274-3467 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C274-3467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C274-3467?
Check Price and Availability of C274-3467, 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 C274-3467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C274-3467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C274-3467
  • 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 C274-3467 available by request