C301-9394 Screening compound: 2,6-dimethoxy-4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)carbamoyl]phenyl ethyl carbonate

C301-9394 Screening compound: 2,6-dimethoxy-4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)carbamoyl]phenyl ethyl carbonate
C301-9394 Screening compound: 2,6-dimethoxy-4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)carbamoyl]phenyl ethyl carbonate alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-9394
2,6-dimethoxy-4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)carbamoyl]phenyl ethyl carbonate

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

C301-9394

Molecular Formula

C20H20N2O8 (C20 H20 N2 O8)

Compound Name

2,6-dimethoxy-4-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)carbamoyl]phenyl ethyl carbonate

IUPAC name

26-dimethoxy-4-[(3-methyl-2-oxo-23-dihydro-13-benzoxazol-6-yl)carbamoyl]phenyl ethyl carbonate

SMILES

CCOC(Oc(c(OC)cc(C(Nc(cc1)cc(O2)c1N(C)C2=O)=O)c1)c1OC)=O

InChI

InChI=1S/C20H20N2O8/c1-5-28-20(25)30-17-15(26-3)8-11(9-16(17)27-4)18(23)21-12-6-7-13-14(10-12)29-19(24)22(13)2/h6-10H,5H2,1-4H3,(H,21,23)

InChI Key

WCKSXIVHBOGYDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26964116

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.39

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.990

Distribution Coefficient, logD

1.990

Water Solubility, LogSw

-2.81

Polar Surface Area

90.395

Acid Dissociation Constant (pKa)

11.16

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with C301-9394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-9394?
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What is the minimum amount of C301-9394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-9394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-9394
  • 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 C301-9394 available by request