K781-1994 Screening compound: N-[(2-chlorophenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)formamido]propanamide

K781-1994 Screening compound: N-[(2-chlorophenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)formamido]propanamide
K781-1994 Screening compound: N-[(2-chlorophenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)formamido]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K781-1994
N-[(2-chlorophenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)formamido]propanamide

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

K781-1994

Molecular Formula

C20H23ClN2O5 (C20 H23 ClN2 O5)

Compound Name

N-[(2-chlorophenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)formamido]propanamide

IUPAC name

N-[(2-chlorophenyl)methyl]-3-[(345-trimethoxyphenyl)formamido]propanamide

SMILES

COc1cc(C(NCCC(NCc(cccc2)c2Cl)=O)=O)cc(OC)c1OC

InChI

InChI=1S/C20H23ClN2O5/c1-26-16-10-14(11-17(27-2)19(16)28-3)20(25)22-9-8-18(24)23-12-13-6-4-5-7-15(13)21/h4-7,10-11H,8-9,12H2,1-3H3,(H,22,25)(H,23,24)

InChI Key

HPFVMYOUOIGRPK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02936760

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.87

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.342

Distribution Coefficient, logD

2.342

Water Solubility, LogSw

-3.35

Polar Surface Area

71.943

Acid Dissociation Constant (pKa)

12.94

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with K781-1994 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K781-1994?
Check Price and Availability of K781-1994, 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 K781-1994 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K781-1994
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K781-1994
  • 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 K781-1994 available by request