8010-3092 Screening compound: 2-(2,6-dichlorophenyl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinane

8010-3092 Screening compound: 2-(2,6-dichlorophenyl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinane
8010-3092 Screening compound: 2-(2,6-dichlorophenyl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinane alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-3092
2-(2,6-dichlorophenyl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinane

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

8010-3092

Molecular Formula

C26H28Cl2N2O2 (C26 H28 Cl2 N2 O2)

Compound Name

2-(2,6-dichlorophenyl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinane

IUPAC name

2-(26-dichlorophenyl)-13-bis[(4-methoxyphenyl)methyl]-13-diazinane

SMILES

COc1ccc(CN2C(c(c(Cl)ccc3)c3Cl)N(Cc(cc3)ccc3OC)CCC2)cc1

InChI

InChI=1S/C26H28Cl2N2O2/c1-31-21-11-7-19(8-12-21)17-29-15-4-16-30(18-20-9-13-22(32-2)14-10-20)26(29)25-23(27)5-3-6-24(25)28/h3,5-14,26H,4,15-18H2,1-2H3

InChI Key

ZCZTVVKEVMAISE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01872998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.435

Distribution Coefficient, logD

5.429

Water Solubility, LogSw

-6.02

Polar Surface Area

21.800

Acid Dissociation Constant (pKa)

25.98

Base Dissociation Constant (pKb)

5.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

8010-3092 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 8010-3092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-3092?
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What is the minimum amount of 8010-3092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-3092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-3092
  • 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 8010-3092 available by request