Y207-5476 Screening compound: 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-N~5~-(2-{[2-(4-nitrophenyl)acetyl]amino}ethyl)-1,2,4-oxadiazole-5-carboxamide

Y207-5476 Screening compound: 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-N~5~-(2-{[2-(4-nitrophenyl)acetyl]amino}ethyl)-1,2,4-oxadiazole-5-carboxamide
Y207-5476 Screening compound: 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-N~5~-(2-{[2-(4-nitrophenyl)acetyl]amino}ethyl)-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y207-5476
3-[(4-chloro-1H-pyrazol-1-yl)methyl]-N~5~-(2-{[2-(4-nitrophenyl)acetyl]amino}ethyl)-1,2,4-oxadiazole-5-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

Y207-5476

Molecular Formula

C17H16ClN7O5 (C17 H16 ClN7 O5)

Compound Name

3-[(4-chloro-1H-pyrazol-1-yl)methyl]-N~5~-(2-{[2-(4-nitrophenyl)acetyl]amino}ethyl)-1,2,4-oxadiazole-5-carboxamide

IUPAC name

N-[2-({3-[(4-chloro-1H-pyrazol-1-yl)methyl]-124-oxadiazol-5-yl}formamido)ethyl]-2-(4-nitrophenyl)acetamide

SMILES

[O-][N+](c1ccc(CC(NCCNC(c2nc(Cn3ncc(Cl)c3)no2)=O)=O)cc1)=O

InChI

InChI=1S/C17H16ClN7O5/c18-12-8-21-24(9-12)10-14-22-17(30-23-14)16(27)20-6-5-19-15(26)7-11-1-3-13(4-2-11)25(28)29/h1-4,8-9H,5-7,10H2,(H,19,26)(H,20,27)

InChI Key

QWCONGJTXFCTOC-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.81

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

0.132

Distribution Coefficient, logD

0.132

Water Solubility, LogSw

-2.30

Polar Surface Area

129.633

Acid Dissociation Constant (pKa)

13.55

Base Dissociation Constant (pKb)

1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.53

References: we are preparing a list of scientific research reports with Y207-5476 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y207-5476?
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What is the minimum amount of Y207-5476 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y207-5476
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y207-5476
  • 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 Y207-5476 available by request