C274-3523 Screening compound: 4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(2,4-dimethoxyphenyl)cyclohexane-1-carboxamide

C274-3523 Screening compound: 4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(2,4-dimethoxyphenyl)cyclohexane-1-carboxamide
C274-3523 Screening compound: 4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(2,4-dimethoxyphenyl)cyclohexane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C274-3523
4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(2,4-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

C274-3523

Molecular Formula

C20H25BrN2O5S2 (C20 H25 BrN2 O5 S2)

Compound Name

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

IUPAC name

4-[(5-bromothiophene-2-sulfonamido)methyl]-N-(24-dimethoxyphenyl)cyclohexane-1-carboxamide

SMILES

COc(cc1)cc(OC)c1NC(C1CCC(CNS(c(s2)ccc2Br)(=O)=O)CC1)=O

InChI

InChI=1S/C20H25BrN2O5S2/c1-27-15-7-8-16(17(11-15)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

FMCXYZIJKFURRX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14740342

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

4.585

Distribution Coefficient, logD

4.584

Water Solubility, LogSw

-4.49

Polar Surface Area

80.775

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

C274-3523 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 C274-3523 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C274-3523?
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What is the minimum amount of C274-3523 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C274-3523
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C274-3523
  • 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 C274-3523 available by request