G877-0078 Screening compound: 2-[(1-cyclohexyl-1H-imidazol-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide

G877-0078 Screening compound: 2-[(1-cyclohexyl-1H-imidazol-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide
G877-0078 Screening compound: 2-[(1-cyclohexyl-1H-imidazol-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G877-0078
2-[(1-cyclohexyl-1H-imidazol-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide

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

G877-0078

Molecular Formula

C17H20N4O3S (C17 H20 N4 O3 S)

Compound Name

2-[(1-cyclohexyl-1H-imidazol-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide

IUPAC name

2-[(1-cyclohexyl-1H-imidazol-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide

SMILES

[O-][N+](c(cc1)ccc1NC(CSc1nccn1C1CCCCC1)=O)=O

InChI

InChI=1S/C17H20N4O3S/c22-16(19-13-6-8-15(9-7-13)21(23)24)12-25-17-18-10-11-20(17)14-4-2-1-3-5-14/h6-11,14H,1-5,12H2,(H,19,22)

InChI Key

KNQXQRYTAVXWDC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09239213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.653

Distribution Coefficient, logD

3.647

Water Solubility, LogSw

-3.86

Polar Surface Area

68.881

Acid Dissociation Constant (pKa)

9.89

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

References: we are preparing a list of scientific research reports with G877-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G877-0078?
Check Price and Availability of G877-0078, 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 G877-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G877-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G877-0078
  • 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 G877-0078 available by request