D505-1425 Screening compound: 2-[4-(4-methyl-3-sulfamoylphenyl)-1-oxo-1,2,5,6,7,8-hexahydrophthalazin-2-yl]-N-(2,4,6-trimethylphenyl)acetamide

D505-1425 Screening compound: 2-[4-(4-methyl-3-sulfamoylphenyl)-1-oxo-1,2,5,6,7,8-hexahydrophthalazin-2-yl]-N-(2,4,6-trimethylphenyl)acetamide
D505-1425 Screening compound: 2-[4-(4-methyl-3-sulfamoylphenyl)-1-oxo-1,2,5,6,7,8-hexahydrophthalazin-2-yl]-N-(2,4,6-trimethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D505-1425
2-[4-(4-methyl-3-sulfamoylphenyl)-1-oxo-1,2,5,6,7,8-hexahydrophthalazin-2-yl]-N-(2,4,6-trimethylphenyl)acetamide

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

D505-1425

Molecular Formula

C26H30N4O4S (C26 H30 N4 O4 S)

Compound Name

2-[4-(4-methyl-3-sulfamoylphenyl)-1-oxo-1,2,5,6,7,8-hexahydrophthalazin-2-yl]-N-(2,4,6-trimethylphenyl)acetamide

IUPAC name

2-[4-(4-methyl-3-sulfamoylphenyl)-1-oxo-125678-hexahydrophthalazin-2-yl]-N-(246-trimethylphenyl)acetamide

SMILES

Cc(cc1C)cc(C)c1NC(CN(C(C1=C2CCCC1)=O)N=C2c1cc(S(N)(=O)=O)c(C)cc1)=O

InChI

InChI=1S/C26H30N4O4S/c1-15-11-17(3)24(18(4)12-15)28-23(31)14-30-26(32)21-8-6-5-7-20(21)25(29-30)19-10-9-16(2)22(13-19)35(27,33)34/h9-13H,5-8,14H2,1-4H3,(H,28,31)(H2,27,33,34)

InChI Key

BEBUTVCSKVVHJQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27589882

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.61

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.078

Distribution Coefficient, logD

4.070

Water Solubility, LogSw

-4.31

Polar Surface Area

99.744

Acid Dissociation Constant (pKa)

9.08

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

D505-1425 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D505-1425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D505-1425?
Check Price and Availability of D505-1425, 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 D505-1425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D505-1425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D505-1425
  • 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 D505-1425 available by request