V020-3222 Screening compound: 2-[4-(2,4-difluorophenyl)-1-(2,4-dimethylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(3-methoxypropyl)acetamide

V020-3222 Screening compound: 2-[4-(2,4-difluorophenyl)-1-(2,4-dimethylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(3-methoxypropyl)acetamide
V020-3222 Screening compound: 2-[4-(2,4-difluorophenyl)-1-(2,4-dimethylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(3-methoxypropyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-3222
2-[4-(2,4-difluorophenyl)-1-(2,4-dimethylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(3-methoxypropyl)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

V020-3222

Molecular Formula

C32H32F2N4O3S (C32 H32 F2 N4 O3 S)

Compound Name

2-[4-(2,4-difluorophenyl)-1-(2,4-dimethylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(3-methoxypropyl)acetamide

IUPAC name

2-[4-(24-difluorophenyl)-1-(24-dimethylphenyl)-7-oxo-3-phenyl-1H4H6H7H8H-pyrazolo[34-e][14]thiazepin-8-yl]-N-(3-methoxypropyl)acetamide

SMILES

Cc(cc1)cc(C)c1-n(c(N1CC(NCCCOC)=O)c2C(c(ccc(F)c3)c3F)SCC1=O)nc2-c1ccccc1

InChI

InChI=1S/C32H32F2N4O3S/c1-20-10-13-26(21(2)16-20)38-32-29(30(36-38)22-8-5-4-6-9-22)31(24-12-11-23(33)17-25(24)34)42-19-28(40)37(32)18-27(39)35-14-7-15-41-3/h4-6,8-13,16-17,31H,7,14-15,18-19H2,1-3H3,(H,35,39)/t31-/m1/s1

InChI Key

NFSXBJYQRAIMFL-WJOKGBTCSA-N

MDL Number (MFCD)

MFCD19789691

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

590.69

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.013

Distribution Coefficient, logD

6.013

Water Solubility, LogSw

-5.38

Polar Surface Area

62.651

Acid Dissociation Constant (pKa)

15.65

Base Dissociation Constant (pKb)

4.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.10

References: we are preparing a list of scientific research reports with V020-3222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-3222?
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What is the minimum amount of V020-3222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-3222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-3222
  • 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 V020-3222 available by request