D073-0105 Screening compound: 4-chloro-N-({6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl}methyl)-N-phenylbenzene-1-sulfonamide

D073-0105 Screening compound: 4-chloro-N-({6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl}methyl)-N-phenylbenzene-1-sulfonamide
D073-0105 Screening compound: 4-chloro-N-({6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl}methyl)-N-phenylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D073-0105
4-chloro-N-({6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl}methyl)-N-phenylbenzene-1-sulfonamide

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

D073-0105

Molecular Formula

C23H18ClN5O2S (C23 H18 ClN5 O2 S)

Compound Name

4-chloro-N-({6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl}methyl)-N-phenylbenzene-1-sulfonamide

IUPAC name

4-chloro-N-({6-methyl-[124]triazolo[34-a]phthalazin-3-yl}methyl)-N-phenylbenzene-1-sulfonamide

SMILES

Cc(c1c2cccc1)nn1c2nnc1CN(c1ccccc1)S(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C23H18ClN5O2S/c1-16-20-9-5-6-10-21(20)23-26-25-22(29(23)27-16)15-28(18-7-3-2-4-8-18)32(30,31)19-13-11-17(24)12-14-19/h2-14H,15H2,1H3

InChI Key

VEAUENRPNSWLGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06013239

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.95

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.996

Distribution Coefficient, logD

3.996

Water Solubility, LogSw

-4.45

Polar Surface Area

66.050

Acid Dissociation Constant (pKa)

22.68

Base Dissociation Constant (pKb)

1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

D073-0105 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D073-0105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D073-0105?
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What is the minimum amount of D073-0105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D073-0105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D073-0105
  • 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 D073-0105 available by request