C602-0141 Screening compound: ethyl 2-{6-[bis(2-methylpropyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate

C602-0141 Screening compound: ethyl 2-{6-[bis(2-methylpropyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate
C602-0141 Screening compound: ethyl 2-{6-[bis(2-methylpropyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound C602-0141
ethyl 2-{6-[bis(2-methylpropyl)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

C602-0141

Molecular Formula

C19H28N2O6S (C19 H28 N2 O6 S)

Compound Name

ethyl 2-{6-[bis(2-methylpropyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate

IUPAC name

ethyl 2-{6-[bis(2-methylpropyl)sulfamoyl]-2-oxo-23-dihydro-13-benzoxazol-3-yl}acetate

SMILES

CCOC(CN(c(ccc(S(N(CC(C)C)CC(C)C)(=O)=O)c1)c1O1)C1=O)=O

InChI

InChI=1S/C19H28N2O6S/c1-6-26-18(22)12-21-16-8-7-15(9-17(16)27-19(21)23)28(24,25)20(10-13(2)3)11-14(4)5/h7-9,13-14H,6,10-12H2,1-5H3

InChI Key

LKZDVEABYMYKRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14775052

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.622

Distribution Coefficient, logD

3.622

Water Solubility, LogSw

-3.99

Polar Surface Area

75.144

Acid Dissociation Constant (pKa)

21.47

Base Dissociation Constant (pKb)

-3.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

C602-0141 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C602-0141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C602-0141?
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What is the minimum amount of C602-0141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C602-0141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C602-0141
  • 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 C602-0141 available by request