E667-1350 Screening compound: N-[(2-methoxyphenyl)methyl]-3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)sulfonyl]butanamide

E667-1350 Screening compound: N-[(2-methoxyphenyl)methyl]-3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)sulfonyl]butanamide
E667-1350 Screening compound: N-[(2-methoxyphenyl)methyl]-3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)sulfonyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E667-1350
N-[(2-methoxyphenyl)methyl]-3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)sulfonyl]butanamide

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

E667-1350

Molecular Formula

C21H24N2O6S (C21 H24 N2 O6 S)

Compound Name

N-[(2-methoxyphenyl)methyl]-3-[(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)sulfonyl]butanamide

IUPAC name

N-[(2-methoxyphenyl)methyl]-3-[(6-methyl-3-oxo-34-dihydro-2H-14-benzoxazin-7-yl)sulfonyl]butanamide

SMILES

CC(CC(NCc(cccc1)c1OC)=O)S(c(cc1OC2)c(C)cc1NC2=O)(=O)=O

InChI

InChI=1S/C21H24N2O6S/c1-13-8-16-18(29-12-21(25)23-16)10-19(13)30(26,27)14(2)9-20(24)22-11-15-6-4-5-7-17(15)28-3/h4-8,10,14H,9,11-12H2,1-3H3,(H,22,24)(H,23,25)/t14-/m0/s1

InChI Key

PMRZEQZNSLVNCC-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD14909160

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.740

Distribution Coefficient, logD

1.740

Water Solubility, LogSw

-2.55

Polar Surface Area

95.111

Acid Dissociation Constant (pKa)

10.76

Base Dissociation Constant (pKb)

-3.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with E667-1350 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E667-1350?
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What is the minimum amount of E667-1350 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E667-1350
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E667-1350
  • 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 E667-1350 available by request