F064-0110 Screening compound: methyl 2-(6-{benzyl[2-(dimethylamino)ethyl]sulfamoyl}-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate

F064-0110 Screening compound: methyl 2-(6-{benzyl[2-(dimethylamino)ethyl]sulfamoyl}-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate
F064-0110 Screening compound: methyl 2-(6-{benzyl[2-(dimethylamino)ethyl]sulfamoyl}-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound F064-0110
methyl 2-(6-{benzyl[2-(dimethylamino)ethyl]sulfamoyl}-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate

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

F064-0110

Molecular Formula

C21H25N3O6S (C21 H25 N3 O6 S)

Compound Name

methyl 2-(6-{benzyl[2-(dimethylamino)ethyl]sulfamoyl}-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate

IUPAC name

methyl 2-(6-{benzyl[2-(dimethylamino)ethyl]sulfamoyl}-2-oxo-23-dihydro-13-benzoxazol-3-yl)acetate

SMILES

CN(C)CCN(Cc1ccccc1)S(c(cc1)cc(O2)c1N(CC(OC)=O)C2=O)(=O)=O

InChI

InChI=1S/C21H25N3O6S/c1-22(2)11-12-23(14-16-7-5-4-6-8-16)31(27,28)17-9-10-18-19(13-17)30-21(26)24(18)15-20(25)29-3/h4-10,13H,11-12,14-15H2,1-3H3

InChI Key

HZONDVKEKVPMOH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27097933

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.51

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.015

Distribution Coefficient, logD

1.469

Water Solubility, LogSw

-2.82

Polar Surface Area

79.137

Acid Dissociation Constant (pKa)

20.89

Base Dissociation Constant (pKb)

7.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

F064-0110 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F064-0110 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F064-0110?
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What is the minimum amount of F064-0110 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F064-0110
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F064-0110
  • 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 F064-0110 available by request