0820-0873 Screening compound: 4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)phenyl methyl ether

0820-0873 Screening compound: 4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)phenyl methyl ether
0820-0873 Screening compound: 4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)phenyl methyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound 0820-0873
4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)phenyl methyl ether

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

0820-0873

Molecular Formula

C23H19NO (C23 H19 NO)

Compound Name

4-(2,3-dihydro-1H-benzo[f]cyclopenta[c]quinolin-4-yl)phenyl methyl ether

IUPAC name

12-(4-methoxyphenyl)-11-azatetracyclo[8.7.0.0^{27}.0^{1317}]heptadeca-1(10)2(7)3581113(17)-heptaene

SMILES

COc(cc1)ccc1-c1nc2ccc(cccc3)c3c2c2c1CCC2

InChI

InChI=1S/C23H19NO/c1-25-17-12-9-16(10-13-17)23-20-8-4-7-19(20)22-18-6-3-2-5-15(18)11-14-21(22)24-23/h2-3,5-6,9-14H,4,7-8H2,1H3

InChI Key

IKDXEPTZBJSZTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00373606

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.41

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.978

Distribution Coefficient, logD

5.977

Water Solubility, LogSw

-7.02

Polar Surface Area

16.627

Acid Dissociation Constant (pKa)

15.56

Base Dissociation Constant (pKb)

4.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

0820-0873 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0820-0873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0820-0873?
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What is the minimum amount of 0820-0873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0820-0873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0820-0873
  • 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 0820-0873 available by request