D437-0707 Screening compound: 2-(4-chlorophenoxy)-N-[4-(2,4-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]acetamide

D437-0707 Screening compound: 2-(4-chlorophenoxy)-N-[4-(2,4-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]acetamide
D437-0707 Screening compound: 2-(4-chlorophenoxy)-N-[4-(2,4-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D437-0707
2-(4-chlorophenoxy)-N-[4-(2,4-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]acetamide

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

D437-0707

Molecular Formula

C21H18ClN3O4S (C21 H18 ClN3 O4 S)

Compound Name

2-(4-chlorophenoxy)-N-[4-(2,4-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]acetamide

IUPAC name

2-(4-chlorophenoxy)-N-[4-(24-dimethyl-3-oxo-34-dihydro-2H-14-benzoxazin-6-yl)-13-thiazol-2-yl]acetamide

SMILES

CC1Oc(ccc(-c2csc(NC(COc(cc3)ccc3Cl)=O)n2)c2)c2N(C)C1=O

InChI

InChI=1S/C21H18ClN3O4S/c1-12-20(27)25(2)17-9-13(3-8-18(17)29-12)16-11-30-21(23-16)24-19(26)10-28-15-6-4-14(22)5-7-15/h3-9,11-12H,10H2,1-2H3,(H,23,24,26)/t12-/m1/s1

InChI Key

PVYKESHBIQSPNS-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD10088467

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.294

Distribution Coefficient, logD

4.294

Water Solubility, LogSw

-4.58

Polar Surface Area

63.261

Acid Dissociation Constant (pKa)

11.70

Base Dissociation Constant (pKb)

-1.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

D437-0707 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D437-0707 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D437-0707?
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What is the minimum amount of D437-0707 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D437-0707
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D437-0707
  • 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 D437-0707 available by request