D315-1973 Screening compound: N-[(3,4-diethoxyphenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide

D315-1973 Screening compound: N-[(3,4-diethoxyphenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
D315-1973 Screening compound: N-[(3,4-diethoxyphenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D315-1973
N-[(3,4-diethoxyphenyl)methyl]-2-methyl-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

D315-1973

Molecular Formula

C26H31N3O5S (C26 H31 N3 O5 S)

Compound Name

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

IUPAC name

N-[(34-diethoxyphenyl)methyl]-2-methyl-5-(4-oxo-345678-hexahydrophthalazin-1-yl)benzene-1-sulfonamide

SMILES

CCOc(ccc(CNS(c1c(C)ccc(C(C2=C3CCCC2)=NNC3=O)c1)(=O)=O)c1)c1OCC

InChI

InChI=1S/C26H31N3O5S/c1-4-33-22-13-11-18(14-23(22)34-5-2)16-27-35(31,32)24-15-19(12-10-17(24)3)25-20-8-6-7-9-21(20)26(30)29-28-25/h10-15,27H,4-9,16H2,1-3H3,(H,29,30)

InChI Key

JVHQNYWMUOPGAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14818550

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.62

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.773

Distribution Coefficient, logD

4.772

Water Solubility, LogSw

-4.42

Polar Surface Area

92.729

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with D315-1973 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D315-1973?
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What is the minimum amount of D315-1973 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D315-1973
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D315-1973
  • 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 D315-1973 available by request