C200-1526 Screening compound: 5-amino-1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide

C200-1526 Screening compound: 5-amino-1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
C200-1526 Screening compound: 5-amino-1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-1526
5-amino-1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide

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

C200-1526

Molecular Formula

C17H16N6O5 (C17 H16 N6 O5)

Compound Name

5-amino-1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-N-[(furan-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide

IUPAC name

5-amino-1-{[(2H-13-benzodioxol-5-yl)carbamoyl]methyl}-N-[(furan-2-yl)methyl]-1H-123-triazole-4-carboxamide

SMILES

Nc1c(C(NCc2ccco2)=O)nnn1CC(Nc(cc1)cc2c1OCO2)=O

InChI

InChI=1S/C17H16N6O5/c18-16-15(17(25)19-7-11-2-1-5-26-11)21-22-23(16)8-14(24)20-10-3-4-12-13(6-10)28-9-27-12/h1-6H,7-9,18H2,(H,19,25)(H,20,24)

InChI Key

FDOHALCBGZNUJW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14726104

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.864

Distribution Coefficient, logD

0.864

Water Solubility, LogSw

-2.04

Polar Surface Area

118.623

Acid Dissociation Constant (pKa)

11.58

Base Dissociation Constant (pKb)

3.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

C200-1526 in Drug Discovery

Included in Screening Libraries

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

Dark Chemical Matter Library (18430 compounds)

Regenerative Medicine Focused Library (23016 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C200-1526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-1526?
Check Price and Availability of C200-1526, 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 C200-1526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-1526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-1526
  • 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 C200-1526 available by request