C368-0434 Screening compound: 5-amino-1-{[(2-ethylphenyl)carbamoyl]methyl}-N-phenyl-1H-1,2,3-triazole-4-carboxamide

C368-0434 Screening compound: 5-amino-1-{[(2-ethylphenyl)carbamoyl]methyl}-N-phenyl-1H-1,2,3-triazole-4-carboxamide
C368-0434 Screening compound: 5-amino-1-{[(2-ethylphenyl)carbamoyl]methyl}-N-phenyl-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C368-0434
5-amino-1-{[(2-ethylphenyl)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

C368-0434

Molecular Formula

C19H20N6O2 (C19 H20 N6 O2)

Compound Name

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

IUPAC name

5-amino-1-{[(2-ethylphenyl)carbamoyl]methyl}-N-phenyl-1H-123-triazole-4-carboxamide

SMILES

CCc(cccc1)c1NC(Cn1nnc(C(Nc2ccccc2)=O)c1N)=O

InChI

InChI=1S/C19H20N6O2/c1-2-13-8-6-7-11-15(13)22-16(26)12-25-18(20)17(23-24-25)19(27)21-14-9-4-3-5-10-14/h3-11H,2,12,20H2,1H3,(H,21,27)(H,22,26)

InChI Key

UHOIXPXQDLNBIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14753689

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.997

Distribution Coefficient, logD

1.997

Water Solubility, LogSw

-2.62

Polar Surface Area

91.739

Acid Dissociation Constant (pKa)

12.40

Base Dissociation Constant (pKb)

2.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with C368-0434 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C368-0434?
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What is the minimum amount of C368-0434 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C368-0434
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C368-0434
  • 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 C368-0434 available by request