E216-5638 Screening compound: 8-[1-(2-ethyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

E216-5638 Screening compound: 8-[1-(2-ethyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane
E216-5638 Screening compound: 8-[1-(2-ethyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound E216-5638
8-[1-(2-ethyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

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

E216-5638

Molecular Formula

C25H35N3O5 (C25 H35 N3 O5)

Compound Name

8-[1-(2-ethyl-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-[1-(2-ethyl-6-methyl-34-dihydro-2H-14-benzoxazine-4-carbonyl)piperidine-4-carbonyl]-14-dioxa-8-azaspiro[4.5]decane

SMILES

CCC(C1)Oc(ccc(C)c2)c2N1C(N(CC1)CCC1C(N(CC1)CCC11OCCO1)=O)=O

InChI

InChI=1S/C25H35N3O5/c1-3-20-17-28(21-16-18(2)4-5-22(21)33-20)24(30)27-10-6-19(7-11-27)23(29)26-12-8-25(9-13-26)31-14-15-32-25/h4-5,16,19-20H,3,6-15,17H2,1-2H3/t20-/m1/s1

InChI Key

RAFLBUJQQHUUMG-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD14848381

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.823

Distribution Coefficient, logD

2.823

Water Solubility, LogSw

-3.00

Polar Surface Area

55.685

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.00

E216-5638 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E216-5638 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E216-5638?
Check Price and Availability of E216-5638, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E216-5638 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E216-5638
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E216-5638
  • 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 E216-5638 available by request