D315-1889 Screening compound: 2-methyl-N-(2-methylphenyl)-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide

D315-1889 Screening compound: 2-methyl-N-(2-methylphenyl)-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
D315-1889 Screening compound: 2-methyl-N-(2-methylphenyl)-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D315-1889
2-methyl-N-(2-methylphenyl)-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-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

D315-1889

Molecular Formula

C22H23N3O3S (C22 H23 N3 O3 S)

Compound Name

2-methyl-N-(2-methylphenyl)-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide

IUPAC name

2-methyl-N-(2-methylphenyl)-5-(4-oxo-345678-hexahydrophthalazin-1-yl)benzene-1-sulfonamide

SMILES

Cc(cccc1)c1NS(c1c(C)ccc(C(C2=C3CCCC2)=NNC3=O)c1)(=O)=O

InChI

InChI=1S/C22H23N3O3S/c1-14-7-3-6-10-19(14)25-29(27,28)20-13-16(12-11-15(20)2)21-17-8-4-5-9-18(17)22(26)24-23-21/h3,6-7,10-13,25H,4-5,8-9H2,1-2H3,(H,24,26)

InChI Key

QRWOPOYVEZOLRX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14818507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.780

Distribution Coefficient, logD

4.653

Water Solubility, LogSw

-4.44

Polar Surface Area

76.502

Acid Dissociation Constant (pKa)

7.87

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with D315-1889 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D315-1889?
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What is the minimum amount of D315-1889 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D315-1889
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D315-1889
  • 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 D315-1889 available by request