3730-1266 Screening compound: 4-{N-[(4-chlorophenyl)methyl]methanesulfonamido}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

3730-1266 Screening compound: 4-{N-[(4-chlorophenyl)methyl]methanesulfonamido}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
3730-1266 Screening compound: 4-{N-[(4-chlorophenyl)methyl]methanesulfonamido}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3730-1266
4-{N-[(4-chlorophenyl)methyl]methanesulfonamido}-N-[2-(3,4-dimethoxyphenyl)ethyl]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

3730-1266

Molecular Formula

C25H27ClN2O5S (C25 H27 ClN2 O5 S)

Compound Name

4-{N-[(4-chlorophenyl)methyl]methanesulfonamido}-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

IUPAC name

4-{N-[(4-chlorophenyl)methyl]methanesulfonamido}-N-[2-(34-dimethoxyphenyl)ethyl]benzamide

SMILES

COc(ccc(CCNC(c(cc1)ccc1N(Cc(cc1)ccc1Cl)S(C)(=O)=O)=O)c1)c1OC

InChI

InChI=1S/C25H27ClN2O5S/c1-32-23-13-6-18(16-24(23)33-2)14-15-27-25(29)20-7-11-22(12-8-20)28(34(3,30)31)17-19-4-9-21(26)10-5-19/h4-13,16H,14-15,17H2,1-3H3,(H,27,29)

InChI Key

VMDGEYDOIOLYGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02138675

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

503.02

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.397

Distribution Coefficient, logD

3.397

Water Solubility, LogSw

-4.08

Polar Surface Area

71.072

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

-2.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

3730-1266 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3730-1266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3730-1266?
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What is the minimum amount of 3730-1266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3730-1266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3730-1266
  • 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 3730-1266 available by request