4664-4275 Screening compound: ethyl 4-{2-[N-(2,4-dimethylphenyl)benzenesulfonamido]acetyl}piperazine-1-carboxylate

4664-4275 Screening compound: ethyl 4-{2-[N-(2,4-dimethylphenyl)benzenesulfonamido]acetyl}piperazine-1-carboxylate
4664-4275 Screening compound: ethyl 4-{2-[N-(2,4-dimethylphenyl)benzenesulfonamido]acetyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4664-4275
ethyl 4-{2-[N-(2,4-dimethylphenyl)benzenesulfonamido]acetyl}piperazine-1-carboxylate

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

4664-4275

Molecular Formula

C23H29N3O5S (C23 H29 N3 O5 S)

Compound Name

ethyl 4-{2-[N-(2,4-dimethylphenyl)benzenesulfonamido]acetyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{2-[N-(24-dimethylphenyl)benzenesulfonamido]acetyl}piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(CN(c1c(C)cc(C)cc1)S(c1ccccc1)(=O)=O)=O)=O

InChI

InChI=1S/C23H29N3O5S/c1-4-31-23(28)25-14-12-24(13-15-25)22(27)17-26(21-11-10-18(2)16-19(21)3)32(29,30)20-8-6-5-7-9-20/h5-11,16H,4,12-15,17H2,1-3H3

InChI Key

FYFLIOWEXXUQGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02578656

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.455

Distribution Coefficient, logD

3.455

Water Solubility, LogSw

-3.81

Polar Surface Area

70.664

Acid Dissociation Constant (pKa)

20.71

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

4664-4275 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 4664-4275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4664-4275?
Check Price and Availability of 4664-4275, 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 4664-4275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4664-4275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4664-4275
  • 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 4664-4275 available by request