V010-6827 Screening compound: 1-[(3-chlorophenyl)sulfonyl]-4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)piperazine

V010-6827 Screening compound: 1-[(3-chlorophenyl)sulfonyl]-4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)piperazine
V010-6827 Screening compound: 1-[(3-chlorophenyl)sulfonyl]-4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-6827
1-[(3-chlorophenyl)sulfonyl]-4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)piperazine

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

V010-6827

Molecular Formula

C25H25ClN2O2S (C25 H25 ClN2 O2 S)

Compound Name

1-[(3-chlorophenyl)sulfonyl]-4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)piperazine

IUPAC name

1-(3-chlorobenzenesulfonyl)-4-{tricyclo[9.4.0.0^{38}]pentadeca-1(11)3571214-hexaen-2-yl}piperazine

SMILES

O=S(c1cccc(Cl)c1)(N(CC1)CCN1C(c1c(CC2)cccc1)c1c2cccc1)=O

InChI

InChI=1S/C25H25ClN2O2S/c26-21-8-5-9-22(18-21)31(29,30)28-16-14-27(15-17-28)25-23-10-3-1-6-19(23)12-13-20-7-2-4-11-24(20)25/h1-11,18,25H,12-17H2

InChI Key

MDPZMGGPPKRQCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19963503

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

453

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.039

Distribution Coefficient, logD

6.039

Water Solubility, LogSw

-6.28

Polar Surface Area

33.761

Acid Dissociation Constant (pKa)

21.47

Base Dissociation Constant (pKb)

3.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

V010-6827 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

DGK Inhibitors Library (10558 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
Targets:
  • Kinases
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with V010-6827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-6827?
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What is the minimum amount of V010-6827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-6827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-6827
  • 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 V010-6827 available by request