8002-6962 Screening compound: N'-[(2E)-6b-acetyl-4a,6a-dimethyl-2H,3H,4H,4aH,4bH,5H,6H,6aH,6bH,7H,8H,9H,10H,10aH,11H,11aH,11bH,12H,13H-indeno[2,1-a]phenanthren-2-ylidene]ethoxycarbohydrazide

8002-6962 Screening compound: N'-[(2E)-6b-acetyl-4a,6a-dimethyl-2H,3H,4H,4aH,4bH,5H,6H,6aH,6bH,7H,8H,9H,10H,10aH,11H,11aH,11bH,12H,13H-indeno[2,1-a]phenanthren-2-ylidene]ethoxycarbohydrazide
8002-6962 Screening compound: N'-[(2E)-6b-acetyl-4a,6a-dimethyl-2H,3H,4H,4aH,4bH,5H,6H,6aH,6bH,7H,8H,9H,10H,10aH,11H,11aH,11bH,12H,13H-indeno[2,1-a]phenanthren-2-ylidene]ethoxycarbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-6962
N'-[(2E)-6b-acetyl-4a,6a-dimethyl-2H,3H,4H,4aH,4bH,5H,6H,6aH,6bH,7H,8H,9H,10H,10aH,11H,11aH,11bH,12H,13H-indeno[2,1-a]phenanthren-2-ylidene]ethoxycarbohydrazide

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

8002-6962

Molecular Formula

C28H42N2O3 (C28 H42 N2 O3)

Compound Name

N'-[(2E)-6b-acetyl-4a,6a-dimethyl-2H,3H,4H,4aH,4bH,5H,6H,6aH,6bH,7H,8H,9H,10H,10aH,11H,11aH,11bH,12H,13H-indeno[2,1-a]phenanthren-2-ylidene]ethoxycarbohydrazide

IUPAC name

N'-[(2E4aR6aS6bS)-6b-acetyl-4a6a-dimethyl-2H3H4H4aH4bH5H6H6aH6bH7H8H9H10H10aH11H11aH11bH12H13H-indeno[21-a]phenanthren-2-ylidene]ethoxycarbohydrazide

SMILES

CCOC(N/N=C(\CC1)/C=C(CC2)[C@]1(C)C(CC1)C2C(CC2CCCC3)[C@]1(C)[C@@]23C(C)=O)=O

InChI

InChI=1S/C28H42N2O3/c1-5-33-25(32)30-29-21-11-14-26(3)19(16-21)9-10-22-23(26)12-15-27(4)24(22)17-20-8-6-7-13-28(20,27)18(2)31/h16,20,22-24H,5-15,17H2,1-4H3,(H,30,32)/t20?,22?,23?,24?,26-,27-,28-/m1/s1

InChI Key

ZGBFIPQSPKDRKC-WJIMUTHXSA-N

MDL Number (MFCD)

MFCD03307753

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.65

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.795

Distribution Coefficient, logD

5.746

Water Solubility, LogSw

-5.60

Polar Surface Area

58.011

Acid Dissociation Constant (pKa)

8.32

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

7.00

Percent sp3 carbon bonding

82.10

8002-6962 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Steroid-like Compounds (494 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cardiovascular
  • Metabolic
  • Immune system
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 8002-6962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-6962?
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What is the minimum amount of 8002-6962 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-6962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-6962
  • 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 8002-6962 available by request