1490-0372 Screening compound: 3-methyl-N-[2,2,2-trichloro-1-(4-methylbenzenesulfonyl)ethyl]benzamide

1490-0372 Screening compound: 3-methyl-N-[2,2,2-trichloro-1-(4-methylbenzenesulfonyl)ethyl]benzamide
1490-0372 Screening compound: 3-methyl-N-[2,2,2-trichloro-1-(4-methylbenzenesulfonyl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1490-0372
3-methyl-N-[2,2,2-trichloro-1-(4-methylbenzenesulfonyl)ethyl]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

1490-0372

Molecular Formula

C17H16Cl3NO3S (C17 H16 Cl3 NO3 S)

Compound Name

3-methyl-N-[2,2,2-trichloro-1-(4-methylbenzenesulfonyl)ethyl]benzamide

IUPAC name

3-methyl-N-[222-trichloro-1-(4-methylbenzenesulfonyl)ethyl]benzamide

SMILES

Cc(cc1)ccc1S(C(C(Cl)(Cl)Cl)NC(c1cc(C)ccc1)=O)(=O)=O

InChI

InChI=1S/C17H16Cl3NO3S/c1-11-6-8-14(9-7-11)25(23,24)16(17(18,19)20)21-15(22)13-5-3-4-12(2)10-13/h3-10,16H,1-2H3,(H,21,22)/t16-/m0/s1

InChI Key

LNTCYGANMNVKOY-INIZCTEOSA-N

MDL Number (MFCD)

MFCD00667508

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.74

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

4.527

Distribution Coefficient, logD

4.207

Water Solubility, LogSw

-4.66

Polar Surface Area

54.076

Acid Dissociation Constant (pKa)

7.36

Base Dissociation Constant (pKb)

-11.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 1490-0372 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1490-0372?
Check Price and Availability of 1490-0372, 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 1490-0372 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1490-0372
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1490-0372
  • 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 1490-0372 available by request