D315-1848 Screening compound: N-[(2-chlorophenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide

D315-1848 Screening compound: N-[(2-chlorophenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
D315-1848 Screening compound: N-[(2-chlorophenyl)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 D315-1848
N-[(2-chlorophenyl)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

D315-1848

Molecular Formula

C22H22ClN3O3S (C22 H22 ClN3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(ccc(C(C1=C2CCCC1)=NNC2=O)c1)c1S(NCc(cccc1)c1Cl)(=O)=O

InChI

InChI=1S/C22H22ClN3O3S/c1-14-10-11-15(21-17-7-3-4-8-18(17)22(27)26-25-21)12-20(14)30(28,29)24-13-16-6-2-5-9-19(16)23/h2,5-6,9-12,24H,3-4,7-8,13H2,1H3,(H,26,27)

InChI Key

FUCOCPNYGPNJJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14818478

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.95

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.396

Distribution Coefficient, logD

5.393

Water Solubility, LogSw

-5.83

Polar Surface Area

78.308

Acid Dissociation Constant (pKa)

9.59

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

D315-1848 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with D315-1848 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D315-1848?
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What is the minimum amount of D315-1848 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D315-1848
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D315-1848
  • 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 D315-1848 available by request