V020-6175 Screening compound: 2-[1-(4-fluorophenyl)-4-(3-methylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide

V020-6175 Screening compound: 2-[1-(4-fluorophenyl)-4-(3-methylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide
V020-6175 Screening compound: 2-[1-(4-fluorophenyl)-4-(3-methylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-6175
2-[1-(4-fluorophenyl)-4-(3-methylphenyl)-7-oxo-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)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

V020-6175

Molecular Formula

C30H29FN4O3S (C30 H29 FN4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccc(C(c(c(-c2ccccc2)nn2-c(cc3)ccc3F)c2N2CC(NCCOC)=O)SCC2=O)c1

InChI

InChI=1S/C30H29FN4O3S/c1-20-7-6-10-22(17-20)29-27-28(21-8-4-3-5-9-21)33-35(24-13-11-23(31)12-14-24)30(27)34(26(37)19-39-29)18-25(36)32-15-16-38-2/h3-14,17,29H,15-16,18-19H2,1-2H3,(H,32,36)/t29-/m1/s1

InChI Key

PBQVCJBNFLPMMK-GDLZYMKVSA-N

MDL Number (MFCD)

MFCD19795832

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

544.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.040

Distribution Coefficient, logD

5.040

Water Solubility, LogSw

-4.65

Polar Surface Area

62.952

Acid Dissociation Constant (pKa)

14.59

Base Dissociation Constant (pKb)

-0.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with V020-6175 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-6175?
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What is the minimum amount of V020-6175 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-6175
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-6175
  • 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 V020-6175 available by request