E919-0463 Screening compound: 5-amino-1-{[(4-chlorophenyl)carbamoyl]methyl}-N-[(4-chlorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide

E919-0463 Screening compound: 5-amino-1-{[(4-chlorophenyl)carbamoyl]methyl}-N-[(4-chlorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
E919-0463 Screening compound: 5-amino-1-{[(4-chlorophenyl)carbamoyl]methyl}-N-[(4-chlorophenyl)methyl]-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E919-0463
5-amino-1-{[(4-chlorophenyl)carbamoyl]methyl}-N-[(4-chlorophenyl)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

E919-0463

Molecular Formula

C18H16Cl2N6O2 (C18 H16 Cl2 N6 O2)

Compound Name

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

IUPAC name

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

SMILES

Nc1c(C(NCc(cc2)ccc2Cl)=O)nnn1CC(Nc(cc1)ccc1Cl)=O

InChI

InChI=1S/C18H16Cl2N6O2/c19-12-3-1-11(2-4-12)9-22-18(28)16-17(21)26(25-24-16)10-15(27)23-14-7-5-13(20)6-8-14/h1-8H,9-10,21H2,(H,22,28)(H,23,27)

InChI Key

HWAZWPZHVQIHQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14927888

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.27

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

2.469

Distribution Coefficient, logD

2.469

Water Solubility, LogSw

-3.24

Polar Surface Area

93.759

Acid Dissociation Constant (pKa)

11.09

Base Dissociation Constant (pKb)

1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with E919-0463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E919-0463?
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What is the minimum amount of E919-0463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E919-0463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E919-0463
  • 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 E919-0463 available by request