C602-0231 Screening compound: ethyl 2-{6-[(2-methoxy-5-methylphenyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate

C602-0231 Screening compound: ethyl 2-{6-[(2-methoxy-5-methylphenyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate
C602-0231 Screening compound: ethyl 2-{6-[(2-methoxy-5-methylphenyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound C602-0231
ethyl 2-{6-[(2-methoxy-5-methylphenyl)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

C602-0231

Molecular Formula

C19H20N2O7S (C19 H20 N2 O7 S)

Compound Name

ethyl 2-{6-[(2-methoxy-5-methylphenyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate

IUPAC name

ethyl 2-{6-[(2-methoxy-5-methylphenyl)sulfamoyl]-2-oxo-23-dihydro-13-benzoxazol-3-yl}acetate

SMILES

CCOC(CN(c(ccc(S(Nc(cc(C)cc1)c1OC)(=O)=O)c1)c1O1)C1=O)=O

InChI

InChI=1S/C19H20N2O7S/c1-4-27-18(22)11-21-15-7-6-13(10-17(15)28-19(21)23)29(24,25)20-14-9-12(2)5-8-16(14)26-3/h5-10,20H,4,11H2,1-3H3

InChI Key

XKDYMTBRSZGABT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14775085

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.44

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.414

Distribution Coefficient, logD

2.401

Water Solubility, LogSw

-3.00

Polar Surface Area

91.079

Acid Dissociation Constant (pKa)

8.92

Base Dissociation Constant (pKb)

-6.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with C602-0231 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C602-0231?
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What is the minimum amount of C602-0231 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C602-0231
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C602-0231
  • 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 C602-0231 available by request