E762-0817 Screening compound: 7-chloro-N~5~-(3,4-diethoxyphenethyl)-2,3-dihydro[1,4]oxazino[2,3,4-hi]indole-5-carboxamide

E762-0817 Screening compound: 7-chloro-N~5~-(3,4-diethoxyphenethyl)-2,3-dihydro[1,4]oxazino[2,3,4-hi]indole-5-carboxamide
E762-0817 Screening compound: 7-chloro-N~5~-(3,4-diethoxyphenethyl)-2,3-dihydro[1,4]oxazino[2,3,4-hi]indole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E762-0817
7-chloro-N~5~-(3,4-diethoxyphenethyl)-2,3-dihydro[1,4]oxazino[2,3,4-hi]indole-5-carboxamide

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

E762-0817

Molecular Formula

C23H25ClN2O4 (C23 H25 ClN2 O4)

Compound Name

7-chloro-N~5~-(3,4-diethoxyphenethyl)-2,3-dihydro[1,4]oxazino[2,3,4-hi]indole-5-carboxamide

IUPAC name

5-chloro-N-[2-(34-diethoxyphenyl)ethyl]-9-oxa-1-azatricyclo[6.3.1.0^{412}]dodeca-24(12)57-tetraene-2-carboxamide

SMILES

CCOc(ccc(CCNC(c(n1c2c(cc3)OCC1)cc2c3Cl)=O)c1)c1OCC

InChI

InChI=1S/C23H25ClN2O4/c1-3-28-19-7-5-15(13-21(19)29-4-2)9-10-25-23(27)18-14-16-17(24)6-8-20-22(16)26(18)11-12-30-20/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,25,27)

InChI Key

DFINOSJJKBXQKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14917209

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.832

Distribution Coefficient, logD

3.832

Water Solubility, LogSw

-4.32

Polar Surface Area

46.682

Acid Dissociation Constant (pKa)

12.86

Base Dissociation Constant (pKb)

-0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with E762-0817 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E762-0817?
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What is the minimum amount of E762-0817 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E762-0817
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E762-0817
  • 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 E762-0817 available by request