S322-0020 Screening compound: 2-{2-methyl-1H,2H,3H,4H,5H-pyrido[4,3-b]indol-5-yl}-1-phenylethan-1-ol

S322-0020 Screening compound: 2-{2-methyl-1H,2H,3H,4H,5H-pyrido[4,3-b]indol-5-yl}-1-phenylethan-1-ol
S322-0020 Screening compound: 2-{2-methyl-1H,2H,3H,4H,5H-pyrido[4,3-b]indol-5-yl}-1-phenylethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound S322-0020
2-{2-methyl-1H,2H,3H,4H,5H-pyrido[4,3-b]indol-5-yl}-1-phenylethan-1-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

S322-0020

Molecular Formula

C20H22N2O (C20 H22 N2 O)

Compound Name

2-{2-methyl-1H,2H,3H,4H,5H-pyrido[4,3-b]indol-5-yl}-1-phenylethan-1-ol

IUPAC name

n/a

SMILES

CN(CC1)Cc2c1n(CC(c1ccccc1)O)c1c2cccc1

InChI

InChI=1S/C20H22N2O/c1-21-12-11-19-17(13-21)16-9-5-6-10-18(16)22(19)14-20(23)15-7-3-2-4-8-15/h2-10,20,23H,11-14H2,1H3/t20-/m0/s1

InChI Key

NQTQXTUFBCMGDE-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27617956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.41

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.931

Distribution Coefficient, logD

-1.262

Water Solubility, LogSw

-2.92

Polar Surface Area

20.906

Acid Dissociation Constant (pKa)

14.50

Base Dissociation Constant (pKb)

11.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

S322-0020 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S322-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S322-0020?
Check Price and Availability of S322-0020, 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 S322-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S322-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S322-0020
  • 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 S322-0020 available by request