0087-0025 Screening compound: 11-methylpentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9(14),10,12,15(20),16,18-nonaene

0087-0025 Screening compound: 11-methylpentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9(14),10,12,15(20),16,18-nonaene
0087-0025 Screening compound: 11-methylpentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9(14),10,12,15(20),16,18-nonaene alternative view

Chemical Structure Depiction of ChemDiv screening compound 0087-0025
11-methylpentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9(14),10,12,15(20),16,18-nonaene

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

0087-0025

Molecular Formula

C21H16 (C21 H16)

Compound Name

11-methylpentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9(14),10,12,15(20),16,18-nonaene

IUPAC name

11-methylpentacyclo[6.6.6.0^{27}.0^{914}.0^{1520}]icosa-2469(14)101215(20)1618-nonaene

SMILES

Cc1cc(C(c2c(C34)cccc2)c2c4cccc2)c3cc1

InChI

InChI=1S/C21H16/c1-13-10-11-18-19(12-13)21-16-8-4-2-6-14(16)20(18)15-7-3-5-9-17(15)21/h2-12,20-21H,1H3

InChI Key

ZLGCDLHGOBFHFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00418385

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.36

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

n/a

Partition Coefficient, logP

5.943

Distribution Coefficient, logD

5.943

Water Solubility, LogSw

-5.78

Polar Surface Area

0.000

Acid Dissociation Constant (pKa)

22.80

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with 0087-0025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0087-0025?
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What is the minimum amount of 0087-0025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0087-0025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0087-0025
  • 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 0087-0025 available by request