C200-1411 Screening compound: 5-amino-1-{[(3-methoxyphenyl)carbamoyl]methyl}-N-phenyl-1H-1,2,3-triazole-4-carboxamide

C200-1411 Screening compound: 5-amino-1-{[(3-methoxyphenyl)carbamoyl]methyl}-N-phenyl-1H-1,2,3-triazole-4-carboxamide
C200-1411 Screening compound: 5-amino-1-{[(3-methoxyphenyl)carbamoyl]methyl}-N-phenyl-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-1411
5-amino-1-{[(3-methoxyphenyl)carbamoyl]methyl}-N-phenyl-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

C200-1411

Molecular Formula

C18H18N6O3 (C18 H18 N6 O3)

Compound Name

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

IUPAC name

5-amino-1-{[(3-methoxyphenyl)carbamoyl]methyl}-N-phenyl-1H-123-triazole-4-carboxamide

SMILES

COc1cccc(NC(Cn2nnc(C(Nc3ccccc3)=O)c2N)=O)c1

InChI

InChI=1S/C18H18N6O3/c1-27-14-9-5-8-13(10-14)20-15(25)11-24-17(19)16(22-23-24)18(26)21-12-6-3-2-4-7-12/h2-10H,11,19H2,1H3,(H,20,25)(H,21,26)

InChI Key

ULCMOXXCFHCXAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14726049

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.563

Distribution Coefficient, logD

1.563

Water Solubility, LogSw

-2.34

Polar Surface Area

99.981

Acid Dissociation Constant (pKa)

11.91

Base Dissociation Constant (pKb)

1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

C200-1411 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C200-1411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-1411?
Check Price and Availability of C200-1411, 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 C200-1411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-1411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-1411
  • 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 C200-1411 available by request