3651-6112 Screening compound: 4-(4-pentylcyclohexyl)phenyl 2-(9-oxo-9,10-dihydroacridin-10-yl)acetate

3651-6112 Screening compound: 4-(4-pentylcyclohexyl)phenyl 2-(9-oxo-9,10-dihydroacridin-10-yl)acetate
3651-6112 Screening compound: 4-(4-pentylcyclohexyl)phenyl 2-(9-oxo-9,10-dihydroacridin-10-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3651-6112
4-(4-pentylcyclohexyl)phenyl 2-(9-oxo-9,10-dihydroacridin-10-yl)acetate

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

3651-6112

Molecular Formula

C32H35NO3 (C32 H35 NO3)

Compound Name

4-(4-pentylcyclohexyl)phenyl 2-(9-oxo-9,10-dihydroacridin-10-yl)acetate

IUPAC name

4-(4-pentylcyclohexyl)phenyl 2-(9-oxo-910-dihydroacridin-10-yl)acetate

SMILES

CCCCCC(CC1)CCC1c(cc1)ccc1OC(CN(c1c2cccc1)c(cccc1)c1C2=O)=O

InChI

InChI=1S/C32H35NO3/c1-2-3-4-9-23-14-16-24(17-15-23)25-18-20-26(21-19-25)36-31(34)22-33-29-12-7-5-10-27(29)32(35)28-11-6-8-13-30(28)33/h5-8,10-13,18-21,23-24H,2-4,9,14-17,22H2,1H3

InChI Key

FNJJMAXHKXZLLG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02643471

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.63

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.789

Distribution Coefficient, logD

8.789

Water Solubility, LogSw

-5.96

Polar Surface Area

34.407

Acid Dissociation Constant (pKa)

19.70

Base Dissociation Constant (pKb)

-5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

3651-6112 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3651-6112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3651-6112?
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What is the minimum amount of 3651-6112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3651-6112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3651-6112
  • 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 3651-6112 available by request