2332-2492 Screening compound: 4-(benzenesulfonyl)-2-[(2,4-dichlorophenoxy)methyl]-N,N-dimethyl-1,3-oxazol-5-amine

2332-2492 Screening compound: 4-(benzenesulfonyl)-2-[(2,4-dichlorophenoxy)methyl]-N,N-dimethyl-1,3-oxazol-5-amine
2332-2492 Screening compound: 4-(benzenesulfonyl)-2-[(2,4-dichlorophenoxy)methyl]-N,N-dimethyl-1,3-oxazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2332-2492
4-(benzenesulfonyl)-2-[(2,4-dichlorophenoxy)methyl]-N,N-dimethyl-1,3-oxazol-5-amine

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

2332-2492

Molecular Formula

C18H16Cl2N2O4S (C18 H16 Cl2 N2 O4 S)

Compound Name

4-(benzenesulfonyl)-2-[(2,4-dichlorophenoxy)methyl]-N,N-dimethyl-1,3-oxazol-5-amine

IUPAC name

4-(benzenesulfonyl)-2-[(24-dichlorophenoxy)methyl]-NN-dimethyl-13-oxazol-5-amine

SMILES

CN(C)c(oc(COc(ccc(Cl)c1)c1Cl)n1)c1S(c1ccccc1)(=O)=O

InChI

InChI=1S/C18H16Cl2N2O4S/c1-22(2)18-17(27(23,24)13-6-4-3-5-7-13)21-16(26-18)11-25-15-9-8-12(19)10-14(15)20/h3-10H,11H2,1-2H3

InChI Key

SCJXJXOFXJAJJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01409300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.181

Distribution Coefficient, logD

4.181

Water Solubility, LogSw

-4.36

Polar Surface Area

58.082

Acid Dissociation Constant (pKa)

29.83

Base Dissociation Constant (pKb)

-2.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

2332-2492 in Drug Discovery

Included in Screening Libraries

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

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 2332-2492 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2332-2492?
Check Price and Availability of 2332-2492, 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 2332-2492 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2332-2492
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2332-2492
  • 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 2332-2492 available by request