V020-6343 Screening compound: 11-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}-2-methyldibenzo[b,f][1,4]oxazepine

V020-6343 Screening compound: 11-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}-2-methyldibenzo[b,f][1,4]oxazepine
V020-6343 Screening compound: 11-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}-2-methyldibenzo[b,f][1,4]oxazepine alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-6343
11-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}-2-methyldibenzo[b,f][1,4]oxazepine

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

V020-6343

Molecular Formula

C25H24FN3O3S (C25 H24 FN3 O3 S)

Compound Name

11-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}-2-methyldibenzo[b,f][1,4]oxazepine

IUPAC name

10-[4-(4-fluorobenzenesulfonyl)-14-diazepan-1-yl]-13-methyl-2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)35791214-heptaene

SMILES

Cc(cc1)cc2c1Oc(cccc1)c1N=C2N(CCC1)CCN1S(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C25H24FN3O3S/c1-18-7-12-23-21(17-18)25(27-22-5-2-3-6-24(22)32-23)28-13-4-14-29(16-15-28)33(30,31)20-10-8-19(26)9-11-20/h2-3,5-12,17H,4,13-16H2,1H3

InChI Key

LGHZTBKNBQPXJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14284399

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

465.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.610

Distribution Coefficient, logD

3.308

Water Solubility, LogSw

-4.50

Polar Surface Area

50.112

Acid Dissociation Constant (pKa)

27.52

Base Dissociation Constant (pKb)

8.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

V020-6343 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V020-6343 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-6343?
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What is the minimum amount of V020-6343 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-6343
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-6343
  • 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 V020-6343 available by request