3389-2711 Screening compound: (2E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

3389-2711 Screening compound: (2E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
3389-2711 Screening compound: (2E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3389-2711
(2E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

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

3389-2711

Molecular Formula

C29H30ClNO3 (C29 H30 ClNO3)

Compound Name

(2E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

IUPAC name

(2E)-1-[4-(4-chlorophenyl)-224-trimethyl-1234-tetrahydroquinolin-1-yl]-3-(34-dimethoxyphenyl)prop-2-en-1-one

SMILES

CC(C)(CC1(C)c(cc2)ccc2Cl)N(C(/C=C/c(cc2)cc(OC)c2OC)=O)c2c1cccc2

InChI

InChI=1S/C29H30ClNO3/c1-28(2)19-29(3,21-12-14-22(30)15-13-21)23-8-6-7-9-24(23)31(28)27(32)17-11-20-10-16-25(33-4)26(18-20)34-5/h6-18H,19H2,1-5H3/t29-/m0/s1

InChI Key

UJXXIFODQFEIIM-LJAQVGFWSA-N

MDL Number (MFCD)

MFCD01561679

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.01

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.404

Distribution Coefficient, logD

6.402

Water Solubility, LogSw

-6.22

Polar Surface Area

28.786

Acid Dissociation Constant (pKa)

27.23

Base Dissociation Constant (pKb)

5.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.60

3389-2711 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 3389-2711 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3389-2711?
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What is the minimum amount of 3389-2711 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3389-2711
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3389-2711
  • 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 3389-2711 available by request