6415-1534 Screening compound: N~1~-(2,6-diethylphenyl)-2-[2-oxobenzo[cd]indol-1(2H)-yl]acetamide

6415-1534 Screening compound: N~1~-(2,6-diethylphenyl)-2-[2-oxobenzo[cd]indol-1(2H)-yl]acetamide
6415-1534 Screening compound: N~1~-(2,6-diethylphenyl)-2-[2-oxobenzo[cd]indol-1(2H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6415-1534
N~1~-(2,6-diethylphenyl)-2-[2-oxobenzo[cd]indol-1(2H)-yl]acetamide

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

6415-1534

Molecular Formula

C23H22N2O2 (C23 H22 N2 O2)

Compound Name

N~1~-(2,6-diethylphenyl)-2-[2-oxobenzo[cd]indol-1(2H)-yl]acetamide

IUPAC name

N-(26-diethylphenyl)-2-{3-oxo-2-azatricyclo[6.3.1.0^{412}]dodeca-1(12)46810-pentaen-2-yl}acetamide

SMILES

CCc1cccc(CC)c1NC(CN(c1c(c2ccc3)c3ccc1)C2=O)=O

InChI

InChI=1S/C23H22N2O2/c1-3-15-8-5-9-16(4-2)22(15)24-20(26)14-25-19-13-7-11-17-10-6-12-18(21(17)19)23(25)27/h5-13H,3-4,14H2,1-2H3,(H,24,26)

InChI Key

NKOYNYROSBTKLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04319764

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.587

Distribution Coefficient, logD

4.587

Water Solubility, LogSw

-4.92

Polar Surface Area

37.189

Acid Dissociation Constant (pKa)

13.18

Base Dissociation Constant (pKb)

1.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

6415-1534 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 6415-1534 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6415-1534?
Check Price and Availability of 6415-1534, 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 6415-1534 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6415-1534
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6415-1534
  • 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 6415-1534 available by request