V027-1685 Screening compound: (3-methoxyphenyl){2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazino}methanone

V027-1685 Screening compound: (3-methoxyphenyl){2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazino}methanone
V027-1685 Screening compound: (3-methoxyphenyl){2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazino}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-1685
(3-methoxyphenyl){2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazino}methanone

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

V027-1685

Molecular Formula

C27H24F3N3O3 (C27 H24 F3 N3 O3)

Compound Name

(3-methoxyphenyl){2-methyl-4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]piperazino}methanone

IUPAC name

10-[4-(3-methoxybenzoyl)-3-methylpiperazin-1-yl]-5-(trifluoromethyl)-2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)35791214-heptaene

SMILES

CC(CN(CC1)C2=Nc(ccc(C(F)(F)F)c3)c3Oc3c2cccc3)N1C(c1cc(OC)ccc1)=O

InChI

InChI=1S/C27H24F3N3O3/c1-17-16-32(12-13-33(17)26(34)18-6-5-7-20(14-18)35-2)25-21-8-3-4-9-23(21)36-24-15-19(27(28,29)30)10-11-22(24)31-25/h3-11,14-15,17H,12-13,16H2,1-2H3/t17-/m0/s1

InChI Key

XHHDKEQLSAPIHL-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14282871

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

495.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.120

Distribution Coefficient, logD

4.604

Water Solubility, LogSw

-5.03

Polar Surface Area

41.480

Acid Dissociation Constant (pKa)

26.59

Base Dissociation Constant (pKb)

7.76

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.93

V027-1685 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • 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 V027-1685 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-1685?
Check Price and Availability of V027-1685, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V027-1685 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-1685
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-1685
  • 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 V027-1685 available by request