2460-0789 Screening compound: 2-[4-(3-{[(4-chlorophenyl)methyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol

2460-0789 Screening compound: 2-[4-(3-{[(4-chlorophenyl)methyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol
2460-0789 Screening compound: 2-[4-(3-{[(4-chlorophenyl)methyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 2460-0789
2-[4-(3-{[(4-chlorophenyl)methyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol

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

2460-0789

Molecular Formula

C19H23ClN4O3 (C19 H23 ClN4 O3)

Compound Name

2-[4-(3-{[(4-chlorophenyl)methyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol

IUPAC name

2-[4-(3-{[(4-chlorophenyl)methyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol

SMILES

[O-][N+](c(ccc(N1CCN(CCO)CC1)c1)c1NCc(cc1)ccc1Cl)=O

InChI

InChI=1S/C19H23ClN4O3/c20-16-3-1-15(2-4-16)14-21-18-13-17(5-6-19(18)24(26)27)23-9-7-22(8-10-23)11-12-25/h1-6,13,21,25H,7-12,14H2

InChI Key

JTDLMKJLMBLKIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01446602

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.043

Distribution Coefficient, logD

2.882

Water Solubility, LogSw

-3.39

Polar Surface Area

66.754

Acid Dissociation Constant (pKa)

14.97

Base Dissociation Constant (pKb)

7.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

2460-0789 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 2460-0789 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2460-0789?
Check Price and Availability of 2460-0789, 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 2460-0789 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2460-0789
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2460-0789
  • 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 2460-0789 available by request