4333-2039 Screening compound: ethyl 4-[1-(3,4-dimethoxyphenyl)cyclopentaneamido]benzoate

4333-2039 Screening compound: ethyl 4-[1-(3,4-dimethoxyphenyl)cyclopentaneamido]benzoate
4333-2039 Screening compound: ethyl 4-[1-(3,4-dimethoxyphenyl)cyclopentaneamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4333-2039
ethyl 4-[1-(3,4-dimethoxyphenyl)cyclopentaneamido]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

4333-2039

Molecular Formula

C23H27NO5 (C23 H27 NO5)

Compound Name

ethyl 4-[1-(3,4-dimethoxyphenyl)cyclopentaneamido]benzoate

IUPAC name

ethyl 4-[1-(34-dimethoxyphenyl)cyclopentaneamido]benzoate

SMILES

CCOC(c(cc1)ccc1NC(C1(CCCC1)c(cc1)cc(OC)c1OC)=O)=O

InChI

InChI=1S/C23H27NO5/c1-4-29-21(25)16-7-10-18(11-8-16)24-22(26)23(13-5-6-14-23)17-9-12-19(27-2)20(15-17)28-3/h7-12,15H,4-6,13-14H2,1-3H3,(H,24,26)

InChI Key

FCKNOBHSGKAILO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02736039

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.321

Distribution Coefficient, logD

4.318

Water Solubility, LogSw

-4.30

Polar Surface Area

59.631

Acid Dissociation Constant (pKa)

9.51

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with 4333-2039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4333-2039?
Check Price and Availability of 4333-2039, 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 4333-2039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4333-2039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4333-2039
  • 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 4333-2039 available by request