4386-4366 Screening compound: 2-(3-bromophenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

4386-4366 Screening compound: 2-(3-bromophenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
4386-4366 Screening compound: 2-(3-bromophenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4386-4366
2-(3-bromophenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

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

4386-4366

Molecular Formula

C20H27BrN2O (C20 H27 BrN2 O)

Compound Name

2-(3-bromophenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

IUPAC name

2-(3-bromophenyl)-57-dipropyl-13-diazatricyclo[3.3.1.1^{37}]decan-6-one

SMILES

CCCC(C1)(CN2C(c3cccc(Br)c3)N1CC1(CCC)C2)C1=O

InChI

InChI=1S/C20H27BrN2O/c1-3-8-19-11-22-13-20(9-4-2,18(19)24)14-23(12-19)17(22)15-6-5-7-16(21)10-15/h5-7,10,17H,3-4,8-9,11-14H2,1-2H3

InChI Key

SKWRWLSIRFYNOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02986218

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.972

Distribution Coefficient, logD

4.972

Water Solubility, LogSw

-4.67

Polar Surface Area

19.918

Acid Dissociation Constant (pKa)

26.55

Base Dissociation Constant (pKb)

3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

References: we are preparing a list of scientific research reports with 4386-4366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4386-4366?
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What is the minimum amount of 4386-4366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4386-4366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4386-4366
  • 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 4386-4366 available by request