Y509-5724 Screening compound: (4-methylpiperazino){4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone

Y509-5724 Screening compound: (4-methylpiperazino){4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone
Y509-5724 Screening compound: (4-methylpiperazino){4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y509-5724
(4-methylpiperazino){4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone

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

Y509-5724

Molecular Formula

C15H18N6O3 (C15 H18 N6 O3)

Compound Name

(4-methylpiperazino){4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone

IUPAC name

n/a

SMILES

CN(CC1)CCN1C(c1ccc(Cn(cn2)nc2[N+]([O-])=O)cc1)=O

InChI

InChI=1S/C15H18N6O3/c1-18-6-8-19(9-7-18)14(22)13-4-2-12(3-5-13)10-20-11-16-15(17-20)21(23)24/h2-5,11H,6-10H2,1H3

InChI Key

KGUFGHSPVFJBQB-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.284

Distribution Coefficient, logD

0.153

Water Solubility, LogSw

-1.63

Polar Surface Area

76.759

Acid Dissociation Constant (pKa)

25.46

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with Y509-5724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y509-5724?
Check Price and Availability of Y509-5724, 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 Y509-5724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y509-5724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y509-5724
  • 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 Y509-5724 available by request