D473-0905 Screening compound: N~1~-[4-(diethylamino)phenyl]-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

D473-0905 Screening compound: N~1~-[4-(diethylamino)phenyl]-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide
D473-0905 Screening compound: N~1~-[4-(diethylamino)phenyl]-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-0905
N~1~-[4-(diethylamino)phenyl]-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

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

D473-0905

Molecular Formula

C20H23N3O4S (C20 H23 N3 O4 S)

Compound Name

N~1~-[4-(diethylamino)phenyl]-4-(1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

IUPAC name

N-[4-(diethylamino)phenyl]-4-(113-trioxo-1lambda62-thiazolidin-2-yl)benzamide

SMILES

CCN(CC)c(cc1)ccc1NC(c(cc1)ccc1N(C(CC1)=O)S1(=O)=O)=O

InChI

InChI=1S/C20H23N3O4S/c1-3-22(4-2)17-11-7-16(8-12-17)21-20(25)15-5-9-18(10-6-15)23-19(24)13-14-28(23,26)27/h5-12H,3-4,13-14H2,1-2H3,(H,21,25)

InChI Key

KRDNRFVKKRZNEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10089380

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.107

Distribution Coefficient, logD

1.915

Water Solubility, LogSw

-2.86

Polar Surface Area

71.483

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

7.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

D473-0905 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with D473-0905 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-0905?
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What is the minimum amount of D473-0905 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-0905
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-0905
  • 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 D473-0905 available by request