5974-3166 Screening compound: N-(4-methoxyphenyl)-4-(thietan-3-yloxy)benzamide

5974-3166 Screening compound: N-(4-methoxyphenyl)-4-(thietan-3-yloxy)benzamide
5974-3166 Screening compound: N-(4-methoxyphenyl)-4-(thietan-3-yloxy)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5974-3166
N-(4-methoxyphenyl)-4-(thietan-3-yloxy)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

5974-3166

Molecular Formula

C17H17NO3S (C17 H17 NO3 S)

Compound Name

N-(4-methoxyphenyl)-4-(thietan-3-yloxy)benzamide

IUPAC name

N-(4-methoxyphenyl)-4-(thietan-3-yloxy)benzamide

SMILES

COc(cc1)ccc1NC(c(cc1)ccc1OC1CSC1)=O

InChI

InChI=1S/C17H17NO3S/c1-20-14-8-4-13(5-9-14)18-17(19)12-2-6-15(7-3-12)21-16-10-22-11-16/h2-9,16H,10-11H2,1H3,(H,18,19)

InChI Key

ZREQIKKEDSPJGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01829377

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.347

Distribution Coefficient, logD

3.347

Water Solubility, LogSw

-3.60

Polar Surface Area

37.658

Acid Dissociation Constant (pKa)

11.19

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 5974-3166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5974-3166?
Check Price and Availability of 5974-3166, 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 5974-3166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5974-3166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5974-3166
  • 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 5974-3166 available by request