3807-3900 Screening compound: 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 3-chlorobenzoate

3807-3900 Screening compound: 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 3-chlorobenzoate
3807-3900 Screening compound: 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 3-chlorobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3807-3900
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 3-chlorobenzoate

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

3807-3900

Molecular Formula

C19H18ClNO2 (C19 H18 ClNO2)

Compound Name

2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 3-chlorobenzoate

IUPAC name

224-trimethyl-12-dihydroquinolin-6-yl 3-chlorobenzoate

SMILES

CC1(C)Nc(ccc(OC(c2cccc(Cl)c2)=O)c2)c2C(C)=C1

InChI

InChI=1S/C19H18ClNO2/c1-12-11-19(2,3)21-17-8-7-15(10-16(12)17)23-18(22)13-5-4-6-14(20)9-13/h4-11,21H,1-3H3

InChI Key

VPKMJCUHSSFMNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01036874

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.81

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.108

Distribution Coefficient, logD

5.108

Water Solubility, LogSw

-5.39

Polar Surface Area

31.815

Acid Dissociation Constant (pKa)

18.02

Base Dissociation Constant (pKb)

5.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with 3807-3900 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3807-3900?
Check Price and Availability of 3807-3900, 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 3807-3900 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3807-3900
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3807-3900
  • 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 3807-3900 available by request