D315-1807 Screening compound: N-[(furan-2-yl)methyl]-2-methyl-5-(6-oxo-1,6-dihydropyridazin-3-yl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

D315-1807 Screening compound: N-[(furan-2-yl)methyl]-2-methyl-5-(6-oxo-1,6-dihydropyridazin-3-yl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide
D315-1807 Screening compound: N-[(furan-2-yl)methyl]-2-methyl-5-(6-oxo-1,6-dihydropyridazin-3-yl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D315-1807
N-[(furan-2-yl)methyl]-2-methyl-5-(6-oxo-1,6-dihydropyridazin-3-yl)-N-[(oxolan-2-yl)methyl]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

D315-1807

Molecular Formula

C21H23N3O5S (C21 H23 N3 O5 S)

Compound Name

N-[(furan-2-yl)methyl]-2-methyl-5-(6-oxo-1,6-dihydropyridazin-3-yl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

IUPAC name

N-[(furan-2-yl)methyl]-2-methyl-5-(6-oxo-16-dihydropyridazin-3-yl)-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

SMILES

Cc(ccc(C(C=C1)=NNC1=O)c1)c1S(N(CC1OCCC1)Cc1ccco1)(=O)=O

InChI

InChI=1S/C21H23N3O5S/c1-15-6-7-16(19-8-9-21(25)23-22-19)12-20(15)30(26,27)24(13-17-4-2-10-28-17)14-18-5-3-11-29-18/h2,4,6-10,12,18H,3,5,11,13-14H2,1H3,(H,23,25)/t18-/m1/s1

InChI Key

WSERBLBFZYXNBK-GOSISDBHSA-N

MDL Number (MFCD)

MFCD27580117

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.922

Distribution Coefficient, logD

2.920

Water Solubility, LogSw

-3.36

Polar Surface Area

84.883

Acid Dissociation Constant (pKa)

9.83

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

D315-1807 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D315-1807 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D315-1807?
Check Price and Availability of D315-1807, 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 D315-1807 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D315-1807
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D315-1807
  • 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 D315-1807 available by request