2096-0072 Screening compound: 1-(3,6-diiodo-9H-carbazol-9-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-2-ol

2096-0072 Screening compound: 1-(3,6-diiodo-9H-carbazol-9-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-2-ol
2096-0072 Screening compound: 1-(3,6-diiodo-9H-carbazol-9-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 2096-0072
1-(3,6-diiodo-9H-carbazol-9-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-2-ol

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

2096-0072

Molecular Formula

C20H19I2N3O (C20 H19 I2 N3 O)

Compound Name

1-(3,6-diiodo-9H-carbazol-9-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-2-ol

IUPAC name

1-(36-diiodo-9H-carbazol-9-yl)-3-(35-dimethyl-1H-pyrazol-1-yl)propan-2-ol

SMILES

Cc1cc(C)nn1CC(Cn1c(ccc(I)c2)c2c2c1ccc(I)c2)O

InChI

InChI=1S/C20H19I2N3O/c1-12-7-13(2)25(23-12)11-16(26)10-24-19-5-3-14(21)8-17(19)18-9-15(22)4-6-20(18)24/h3-9,16,26H,10-11H2,1-2H3/t16-/m0/s1

InChI Key

LCIMYZQYBILEQE-INIZCTEOSA-N

MDL Number (MFCD)

MFCD01140927

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

571.2

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.244

Distribution Coefficient, logD

6.244

Water Solubility, LogSw

-5.68

Polar Surface Area

31.569

Acid Dissociation Constant (pKa)

16.48

Base Dissociation Constant (pKb)

1.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

2096-0072 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 2096-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2096-0072?
Check Price and Availability of 2096-0072, 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 2096-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2096-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2096-0072
  • 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 2096-0072 available by request