E216-1371 Screening compound: 2,6-dimethyl-4-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]-3,4-dihydro-2H-1,4-benzoxazine

E216-1371 Screening compound: 2,6-dimethyl-4-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]-3,4-dihydro-2H-1,4-benzoxazine
E216-1371 Screening compound: 2,6-dimethyl-4-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]-3,4-dihydro-2H-1,4-benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E216-1371
2,6-dimethyl-4-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]-3,4-dihydro-2H-1,4-benzoxazine

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

E216-1371

Molecular Formula

C22H31N3O3 (C22 H31 N3 O3)

Compound Name

2,6-dimethyl-4-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]-3,4-dihydro-2H-1,4-benzoxazine

IUPAC name

26-dimethyl-4-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]-34-dihydro-2H-14-benzoxazine

SMILES

CC(C1)Oc(ccc(C)c2)c2N1C(N(CC1)CCC1C(N1CCCCC1)=O)=O

InChI

InChI=1S/C22H31N3O3/c1-16-6-7-20-19(14-16)25(15-17(2)28-20)22(27)24-12-8-18(9-13-24)21(26)23-10-4-3-5-11-23/h6-7,14,17-18H,3-5,8-13,15H2,1-2H3/t17-/m1/s1

InChI Key

QVCLUEAXLKNAKA-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD14847844

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.380

Distribution Coefficient, logD

3.380

Water Solubility, LogSw

-3.51

Polar Surface Area

41.054

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

6.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.60

E216-1371 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 E216-1371 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E216-1371?
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What is the minimum amount of E216-1371 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E216-1371
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E216-1371
  • 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 E216-1371 available by request