1325-0195 Screening compound: 2-chloro-4-[N-(4-chlorobenzenesulfonyl)butanamido]naphthalen-1-yl butanoate

1325-0195 Screening compound: 2-chloro-4-[N-(4-chlorobenzenesulfonyl)butanamido]naphthalen-1-yl butanoate
1325-0195 Screening compound: 2-chloro-4-[N-(4-chlorobenzenesulfonyl)butanamido]naphthalen-1-yl butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1325-0195
2-chloro-4-[N-(4-chlorobenzenesulfonyl)butanamido]naphthalen-1-yl butanoate

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

1325-0195

Molecular Formula

C24H23Cl2NO5S (C24 H23 Cl2 NO5 S)

Compound Name

2-chloro-4-[N-(4-chlorobenzenesulfonyl)butanamido]naphthalen-1-yl butanoate

IUPAC name

2-chloro-4-[N-(4-chlorobenzenesulfonyl)butanamido]naphthalen-1-yl butanoate

SMILES

CCCC(N(c(c1ccccc11)cc(Cl)c1OC(CCC)=O)S(c(cc1)ccc1Cl)(=O)=O)=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.668

Distribution Coefficient, logD

6.668

Water Solubility, LogSw

-6.25

Polar Surface Area

64.946

Acid Dissociation Constant (pKa)

20.65

Base Dissociation Constant (pKb)

-14.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

1325-0195 in Drug Discovery

Included in Screening Libraries

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

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1325-0195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1325-0195?
Check Price and Availability of 1325-0195, 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 1325-0195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1325-0195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1325-0195
  • 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 1325-0195 available by request