C751-0330 Screening compound: 1-(4-bromobenzenesulfonyl)-N-(2,4-dimethylphenyl)-1,2,3,6-tetrahydropyridine-4-carboxamide

C751-0330 Screening compound: 1-(4-bromobenzenesulfonyl)-N-(2,4-dimethylphenyl)-1,2,3,6-tetrahydropyridine-4-carboxamide
C751-0330 Screening compound: 1-(4-bromobenzenesulfonyl)-N-(2,4-dimethylphenyl)-1,2,3,6-tetrahydropyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C751-0330
1-(4-bromobenzenesulfonyl)-N-(2,4-dimethylphenyl)-1,2,3,6-tetrahydropyridine-4-carboxamide

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

C751-0330

Molecular Formula

C20H21BrN2O3S (C20 H21 BrN2 O3 S)

Compound Name

1-(4-bromobenzenesulfonyl)-N-(2,4-dimethylphenyl)-1,2,3,6-tetrahydropyridine-4-carboxamide

IUPAC name

1-(4-bromobenzenesulfonyl)-N-(24-dimethylphenyl)-1236-tetrahydropyridine-4-carboxamide

SMILES

Cc(cc1)cc(C)c1NC(C(CC1)=CCN1S(c(cc1)ccc1Br)(=O)=O)=O

InChI

InChI=1S/C20H21BrN2O3S/c1-14-3-8-19(15(2)13-14)22-20(24)16-9-11-23(12-10-16)27(25,26)18-6-4-17(21)5-7-18/h3-9,13H,10-12H2,1-2H3,(H,22,24)

InChI Key

SLLGFHGBWWCTPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14791605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.852

Distribution Coefficient, logD

4.838

Water Solubility, LogSw

-4.44

Polar Surface Area

54.343

Acid Dissociation Constant (pKa)

10.61

Base Dissociation Constant (pKb)

-1.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C751-0330 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C751-0330 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C751-0330?
Check Price and Availability of C751-0330, 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 C751-0330 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C751-0330
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C751-0330
  • 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 C751-0330 available by request