D505-0003 Screening compound: N-(2-methoxy-5-methylphenyl)-2-methyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide

D505-0003 Screening compound: N-(2-methoxy-5-methylphenyl)-2-methyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
D505-0003 Screening compound: N-(2-methoxy-5-methylphenyl)-2-methyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D505-0003
N-(2-methoxy-5-methylphenyl)-2-methyl-5-(3-methyl-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

D505-0003

Molecular Formula

C24H27N3O4S (C24 H27 N3 O4 S)

Compound Name

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

IUPAC name

N-(2-methoxy-5-methylphenyl)-2-methyl-5-(3-methyl-4-oxo-345678-hexahydrophthalazin-1-yl)benzene-1-sulfonamide

SMILES

Cc(cc1)cc(NS(c2c(C)ccc(C(C3=C4CCCC3)=NN(C)C4=O)c2)(=O)=O)c1OC

InChI

InChI=1S/C24H27N3O4S/c1-15-9-12-21(31-4)20(13-15)26-32(29,30)22-14-17(11-10-16(22)2)23-18-7-5-6-8-19(18)24(28)27(3)25-23/h9-14,26H,5-8H2,1-4H3

InChI Key

CMHZNMWYMOITPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27589700

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.524

Distribution Coefficient, logD

3.860

Water Solubility, LogSw

-4.26

Polar Surface Area

74.920

Acid Dissociation Constant (pKa)

6.84

Base Dissociation Constant (pKb)

-1.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with D505-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D505-0003?
Check Price and Availability of D505-0003, 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 D505-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D505-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D505-0003
  • 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 D505-0003 available by request