3277-0207 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-(3-formyl-1H-indol-1-yl)acetamide

3277-0207 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-(3-formyl-1H-indol-1-yl)acetamide
3277-0207 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-(3-formyl-1H-indol-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3277-0207
N-(2H-1,3-benzodioxol-5-yl)-2-(3-formyl-1H-indol-1-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

3277-0207

Molecular Formula

C18H14N2O4 (C18 H14 N2 O4)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-2-(3-formyl-1H-indol-1-yl)acetamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-2-(3-formyl-1H-indol-1-yl)acetamide

SMILES

O=Cc1cn(CC(Nc(cc2)cc3c2OCO3)=O)c2c1cccc2

InChI

InChI=1S/C18H14N2O4/c21-10-12-8-20(15-4-2-1-3-14(12)15)9-18(22)19-13-5-6-16-17(7-13)24-11-23-16/h1-8,10H,9,11H2,(H,19,22)

InChI Key

UNHDLLXYRPABOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01785703

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.775

Distribution Coefficient, logD

2.775

Water Solubility, LogSw

-3.05

Polar Surface Area

56.395

Acid Dissociation Constant (pKa)

11.07

Base Dissociation Constant (pKb)

1.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

3277-0207 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 3277-0207 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3277-0207?
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What is the minimum amount of 3277-0207 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3277-0207
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3277-0207
  • 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 3277-0207 available by request