3272-1414 Screening compound: 4-{[N-(5-chloro-2-methylphenyl)benzenesulfonamido]methyl}-N,N-diethylbenzamide

3272-1414 Screening compound: 4-{[N-(5-chloro-2-methylphenyl)benzenesulfonamido]methyl}-N,N-diethylbenzamide
3272-1414 Screening compound: 4-{[N-(5-chloro-2-methylphenyl)benzenesulfonamido]methyl}-N,N-diethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3272-1414
4-{[N-(5-chloro-2-methylphenyl)benzenesulfonamido]methyl}-N,N-diethylbenzamide

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

3272-1414

Molecular Formula

C25H27ClN2O3S (C25 H27 ClN2 O3 S)

Compound Name

4-{[N-(5-chloro-2-methylphenyl)benzenesulfonamido]methyl}-N,N-diethylbenzamide

IUPAC name

4-{[N-(5-chloro-2-methylphenyl)benzenesulfonamido]methyl}-NN-diethylbenzamide

SMILES

CCN(CC)C(c1ccc(CN(c2c(C)ccc(Cl)c2)S(c2ccccc2)(=O)=O)cc1)=O

InChI

InChI=1S/C25H27ClN2O3S/c1-4-27(5-2)25(29)21-14-12-20(13-15-21)18-28(24-17-22(26)16-11-19(24)3)32(30,31)23-9-7-6-8-10-23/h6-17H,4-5,18H2,1-3H3

InChI Key

KABDEELUEMVQAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02064281

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.02

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.927

Distribution Coefficient, logD

4.927

Water Solubility, LogSw

-5.00

Polar Surface Area

47.423

Acid Dissociation Constant (pKa)

25.01

Base Dissociation Constant (pKb)

-1.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

3272-1414 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3272-1414 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3272-1414?
Check Price and Availability of 3272-1414, 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 3272-1414 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3272-1414
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3272-1414
  • 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 3272-1414 available by request