V015-4239 Screening compound: 2-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[(furan-2-yl)methyl]acetamide

V015-4239 Screening compound: 2-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[(furan-2-yl)methyl]acetamide
V015-4239 Screening compound: 2-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[(furan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-4239
2-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[(furan-2-yl)methyl]acetamide

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

V015-4239

Molecular Formula

C31H24ClFN4O3S (C31 H24 ClFN4 O3 S)

Compound Name

2-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[(furan-2-yl)methyl]acetamide

IUPAC name

2-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-7-oxo-3-phenyl-1H4H6H7H8H-pyrazolo[34-e][14]thiazepin-8-yl]-N-[(furan-2-yl)methyl]acetamide

SMILES

O=C(CN(c1c(C(c(cc2)ccc2F)SC2)c(-c3ccccc3)nn1-c(cccc1)c1Cl)C2=O)NCc1ccco1

InChI

InChI=1S/C31H24ClFN4O3S/c32-24-10-4-5-11-25(24)37-31-28(29(35-37)20-7-2-1-3-8-20)30(21-12-14-22(33)15-13-21)41-19-27(39)36(31)18-26(38)34-17-23-9-6-16-40-23/h1-16,30H,17-19H2,(H,34,38)/t30-/m1/s1

InChI Key

UTPXLDWSPRFQCH-SSEXGKCCSA-N

MDL Number (MFCD)

MFCD19799052

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

587.07

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.347

Distribution Coefficient, logD

6.347

Water Solubility, LogSw

-6.20

Polar Surface Area

61.944

Acid Dissociation Constant (pKa)

12.96

Base Dissociation Constant (pKb)

-2.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.90

References: we are preparing a list of scientific research reports with V015-4239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-4239?
Check Price and Availability of V015-4239, 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 V015-4239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-4239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-4239
  • 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 V015-4239 available by request