4103-0185 Screening compound: 2-[1,8-dioxo-9-(2-propoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridin-10-yl]acetic acid

4103-0185 Screening compound: 2-[1,8-dioxo-9-(2-propoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridin-10-yl]acetic acid
4103-0185 Screening compound: 2-[1,8-dioxo-9-(2-propoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridin-10-yl]acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 4103-0185
2-[1,8-dioxo-9-(2-propoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridin-10-yl]acetic acid

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

4103-0185

Molecular Formula

C24H27NO5 (C24 H27 NO5)

Compound Name

2-[1,8-dioxo-9-(2-propoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridin-10-yl]acetic acid

IUPAC name

2-[18-dioxo-9-(2-propoxyphenyl)-12345678910-decahydroacridin-10-yl]acetic acid

SMILES

CCCOc1c(C2C(C(CCC3)=O)=C3N(CC(O)=O)C(CCC3)=C2C3=O)cccc1

InChI

InChI=1S/C24H27NO5/c1-2-13-30-20-12-4-3-7-15(20)22-23-16(8-5-10-18(23)26)25(14-21(28)29)17-9-6-11-19(27)24(17)22/h3-4,7,12,22H,2,5-6,8-11,13-14H2,1H3,(H,28,29)

InChI Key

BDUQESOFKYNSRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03016294

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.565

Distribution Coefficient, logD

-0.737

Water Solubility, LogSw

-2.61

Polar Surface Area

64.874

Acid Dissociation Constant (pKa)

4.10

Base Dissociation Constant (pKb)

-5.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.80

4103-0185 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 4103-0185 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4103-0185?
Check Price and Availability of 4103-0185, 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 4103-0185 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4103-0185
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4103-0185
  • 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 4103-0185 available by request