7938-0174 Screening compound: 1-(4-iodobenzenesulfonyl)-2-propyl-1H-imidazole

7938-0174 Screening compound: 1-(4-iodobenzenesulfonyl)-2-propyl-1H-imidazole
7938-0174 Screening compound: 1-(4-iodobenzenesulfonyl)-2-propyl-1H-imidazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 7938-0174
1-(4-iodobenzenesulfonyl)-2-propyl-1H-imidazole

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

7938-0174

Molecular Formula

C12H13IN2O2S (C12 H13 IN2 O2 S)

Compound Name

1-(4-iodobenzenesulfonyl)-2-propyl-1H-imidazole

IUPAC name

1-(4-iodobenzenesulfonyl)-2-propyl-1H-imidazole

SMILES

CCCc1nccn1S(c(cc1)ccc1I)(=O)=O

InChI

InChI=1S/C12H13IN2O2S/c1-2-3-12-14-8-9-15(12)18(16,17)11-6-4-10(13)5-7-11/h4-9H,2-3H2,1H3

InChI Key

VNAOTXSGGQEDPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06590777

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.22

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.572

Distribution Coefficient, logD

3.572

Water Solubility, LogSw

-3.69

Polar Surface Area

39.985

Acid Dissociation Constant (pKa)

27.41

Base Dissociation Constant (pKb)

2.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

7938-0174 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 7938-0174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7938-0174?
Check Price and Availability of 7938-0174, 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 7938-0174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7938-0174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7938-0174
  • 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 7938-0174 available by request