C520-0378 Screening compound: 5-[(4-bromobenzenesulfinyl)methyl]-N-(4-methylcyclohexyl)furan-2-carboxamide

C520-0378 Screening compound: 5-[(4-bromobenzenesulfinyl)methyl]-N-(4-methylcyclohexyl)furan-2-carboxamide
C520-0378 Screening compound: 5-[(4-bromobenzenesulfinyl)methyl]-N-(4-methylcyclohexyl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C520-0378
5-[(4-bromobenzenesulfinyl)methyl]-N-(4-methylcyclohexyl)furan-2-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

C520-0378

Molecular Formula

C19H22BrNO3S (C19 H22 BrNO3 S)

Compound Name

5-[(4-bromobenzenesulfinyl)methyl]-N-(4-methylcyclohexyl)furan-2-carboxamide

IUPAC name

5-[(4-bromobenzenesulfinyl)methyl]-N-(4-methylcyclohexyl)furan-2-carboxamide

SMILES

CC(CC1)CCC1NC(c1ccc(CS(c(cc2)ccc2Br)=O)o1)=O

InChI

InChI=1S/C19H24BrNO3S/c1-13-2-6-15(7-3-13)21-19(22)18-11-8-16(24-18)12-25(23)17-9-4-14(20)5-10-17/h4-5,8-11,13,15H,2-3,6-7,12,25H2,1H3,(H,21,22)

InChI Key

XNIOYUQJTVQYIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14765232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.371

Distribution Coefficient, logD

5.371

Water Solubility, LogSw

-5.48

Polar Surface Area

47.359

Acid Dissociation Constant (pKa)

14.80

Base Dissociation Constant (pKb)

4.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with C520-0378 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C520-0378?
Check Price and Availability of C520-0378, 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 C520-0378 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C520-0378
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C520-0378
  • 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 C520-0378 available by request