E746-0267 Screening compound: N-[(4-methoxyphenyl)methyl]-2-{3-oxo-6-[(propan-2-yl)sulfamoyl]-3,4-dihydro-2H-1,4-benzoxazin-4-yl}acetamide

E746-0267 Screening compound: N-[(4-methoxyphenyl)methyl]-2-{3-oxo-6-[(propan-2-yl)sulfamoyl]-3,4-dihydro-2H-1,4-benzoxazin-4-yl}acetamide
E746-0267 Screening compound: N-[(4-methoxyphenyl)methyl]-2-{3-oxo-6-[(propan-2-yl)sulfamoyl]-3,4-dihydro-2H-1,4-benzoxazin-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E746-0267
N-[(4-methoxyphenyl)methyl]-2-{3-oxo-6-[(propan-2-yl)sulfamoyl]-3,4-dihydro-2H-1,4-benzoxazin-4-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

E746-0267

Molecular Formula

C21H25N3O6S (C21 H25 N3 O6 S)

Compound Name

N-[(4-methoxyphenyl)methyl]-2-{3-oxo-6-[(propan-2-yl)sulfamoyl]-3,4-dihydro-2H-1,4-benzoxazin-4-yl}acetamide

IUPAC name

N-[(4-methoxyphenyl)methyl]-2-{3-oxo-6-[(propan-2-yl)sulfamoyl]-34-dihydro-2H-14-benzoxazin-4-yl}acetamide

SMILES

CC(C)NS(c(cc1)cc(N2CC(NCc(cc3)ccc3OC)=O)c1OCC2=O)(=O)=O

InChI

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

InChI Key

CGRRIOABQXGJTM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14914853

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.887

Distribution Coefficient, logD

1.887

Water Solubility, LogSw

-2.82

Polar Surface Area

97.301

Acid Dissociation Constant (pKa)

11.34

Base Dissociation Constant (pKb)

-1.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with E746-0267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E746-0267?
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What is the minimum amount of E746-0267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E746-0267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E746-0267
  • 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 E746-0267 available by request