8016-1458 Screening compound: 2,4-dichloro-N~1~-(3-chloro-4-morpholinophenyl)-5-[(dimethylamino)sulfonyl]benzamide

8016-1458 Screening compound: 2,4-dichloro-N~1~-(3-chloro-4-morpholinophenyl)-5-[(dimethylamino)sulfonyl]benzamide
8016-1458 Screening compound: 2,4-dichloro-N~1~-(3-chloro-4-morpholinophenyl)-5-[(dimethylamino)sulfonyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-1458
2,4-dichloro-N~1~-(3-chloro-4-morpholinophenyl)-5-[(dimethylamino)sulfonyl]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

8016-1458

Molecular Formula

C19H20Cl3N3O4S (C19 H20 Cl3 N3 O4 S)

Compound Name

2,4-dichloro-N~1~-(3-chloro-4-morpholinophenyl)-5-[(dimethylamino)sulfonyl]benzamide

IUPAC name

24-dichloro-N-[3-chloro-4-(morpholin-4-yl)phenyl]-5-(dimethylsulfamoyl)benzamide

SMILES

CN(C)S(c(cc(C(Nc(cc1)cc(Cl)c1N1CCOCC1)=O)c(Cl)c1)c1Cl)(=O)=O

InChI

InChI=1S/C19H20Cl3N3O4S/c1-24(2)30(27,28)18-10-13(14(20)11-16(18)22)19(26)23-12-3-4-17(15(21)9-12)25-5-7-29-8-6-25/h3-4,9-11H,5-8H2,1-2H3,(H,23,26)

InChI Key

AYMDGUZALRIIFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05260549

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.81

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.116

Distribution Coefficient, logD

3.266

Water Solubility, LogSw

-4.64

Polar Surface Area

68.053

Acid Dissociation Constant (pKa)

6.62

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

References: we are preparing a list of scientific research reports with 8016-1458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-1458?
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What is the minimum amount of 8016-1458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-1458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-1458
  • 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 8016-1458 available by request