3807-4408 Screening compound: 1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl benzoate

3807-4408 Screening compound: 1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl benzoate
3807-4408 Screening compound: 1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3807-4408
1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 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

3807-4408

Molecular Formula

C26H23NO3 (C26 H23 NO3)

Compound Name

1-benzoyl-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl benzoate

IUPAC name

1-benzoyl-224-trimethyl-12-dihydroquinolin-6-yl benzoate

SMILES

CC1(C)N(C(c2ccccc2)=O)c(ccc(OC(c2ccccc2)=O)c2)c2C(C)=C1

InChI

InChI=1S/C26H23NO3/c1-18-17-26(2,3)27(24(28)19-10-6-4-7-11-19)23-15-14-21(16-22(18)23)30-25(29)20-12-8-5-9-13-20/h4-17H,1-3H3

InChI Key

MFQWHYROSXKEEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01171370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.430

Distribution Coefficient, logD

5.430

Water Solubility, LogSw

-5.60

Polar Surface Area

34.702

Acid Dissociation Constant (pKa)

29.90

Base Dissociation Constant (pKb)

-3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 3807-4408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3807-4408?
Check Price and Availability of 3807-4408, 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 3807-4408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3807-4408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3807-4408
  • 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 3807-4408 available by request