V007-2876 Screening compound: 2-[3-tert-butyl-4-(4-fluorophenyl)-1-(3-methylphenyl)-7-oxo-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[2-(dimethylamino)ethyl]acetamide

V007-2876 Screening compound: 2-[3-tert-butyl-4-(4-fluorophenyl)-1-(3-methylphenyl)-7-oxo-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[2-(dimethylamino)ethyl]acetamide
V007-2876 Screening compound: 2-[3-tert-butyl-4-(4-fluorophenyl)-1-(3-methylphenyl)-7-oxo-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[2-(dimethylamino)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-2876
2-[3-tert-butyl-4-(4-fluorophenyl)-1-(3-methylphenyl)-7-oxo-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[2-(dimethylamino)ethyl]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

V007-2876

Molecular Formula

C29H36FN5O2S (C29 H36 FN5 O2 S)

Compound Name

2-[3-tert-butyl-4-(4-fluorophenyl)-1-(3-methylphenyl)-7-oxo-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[2-(dimethylamino)ethyl]acetamide

IUPAC name

2-[3-tert-butyl-4-(4-fluorophenyl)-1-(3-methylphenyl)-7-oxo-1H4H6H7H8H-pyrazolo[34-e][14]thiazepin-8-yl]-N-[2-(dimethylamino)ethyl]acetamide

SMILES

CC(C)(C)c(c(C(c(cc1)ccc1F)SC1)c2N(CC(NCCN(C)C)=O)C1=O)nn2-c1cc(C)ccc1

InChI

InChI=1S/C29H36FN5O2S/c1-19-8-7-9-22(16-19)35-28-25(27(32-35)29(2,3)4)26(20-10-12-21(30)13-11-20)38-18-24(37)34(28)17-23(36)31-14-15-33(5)6/h7-13,16,26H,14-15,17-18H2,1-6H3,(H,31,36)/t26-/m1/s1

InChI Key

IHAJYIFYYMXBNG-AREMUKBSSA-N

MDL Number (MFCD)

MFCD19793997

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

537.7

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

4.843

Distribution Coefficient, logD

3.508

Water Solubility, LogSw

-4.55

Polar Surface Area

58.747

Acid Dissociation Constant (pKa)

13.93

Base Dissociation Constant (pKb)

8.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.40

V007-2876 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V007-2876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-2876?
Check Price and Availability of V007-2876, 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 V007-2876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-2876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-2876
  • 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 V007-2876 available by request