1682-8074 Screening compound: butyl 4-(3,4,5-trimethoxybenzamido)benzoate

1682-8074 Screening compound: butyl 4-(3,4,5-trimethoxybenzamido)benzoate
1682-8074 Screening compound: butyl 4-(3,4,5-trimethoxybenzamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-8074
butyl 4-(3,4,5-trimethoxybenzamido)benzoate

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

1682-8074

Molecular Formula

C21H25NO6 (C21 H25 NO6)

Compound Name

butyl 4-(3,4,5-trimethoxybenzamido)benzoate

IUPAC name

butyl 4-(345-trimethoxybenzamido)benzoate

SMILES

CCCCOC(c(cc1)ccc1NC(c(cc1OC)cc(OC)c1OC)=O)=O

InChI

InChI=1S/C21H25NO6/c1-5-6-11-28-21(24)14-7-9-16(10-8-14)22-20(23)15-12-17(25-2)19(27-4)18(13-15)26-3/h7-10,12-13H,5-6,11H2,1-4H3,(H,22,23)

InChI Key

FMRCCGFIVLIDOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00591712

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.388

Distribution Coefficient, logD

4.388

Water Solubility, LogSw

-4.32

Polar Surface Area

67.355

Acid Dissociation Constant (pKa)

11.04

Base Dissociation Constant (pKb)

-3.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 1682-8074 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-8074?
Check Price and Availability of 1682-8074, 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 1682-8074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-8074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-8074
  • 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 1682-8074 available by request