V016-5956 Screening compound: 3-bromo-4-(cyclobutylmethyl)-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide

V016-5956 Screening compound: 3-bromo-4-(cyclobutylmethyl)-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide
V016-5956 Screening compound: 3-bromo-4-(cyclobutylmethyl)-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-5956
3-bromo-4-(cyclobutylmethyl)-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide

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

V016-5956

Molecular Formula

C15H17BrN2OS (C15 H17 BrN2 OS)

Compound Name

3-bromo-4-(cyclobutylmethyl)-N-(prop-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide

IUPAC name

3-bromo-4-(cyclobutylmethyl)-N-(prop-2-en-1-yl)-4H-thieno[32-b]pyrrole-5-carboxamide

SMILES

C=CCNC(c1cc(scc2Br)c2n1CC1CCC1)=O

InChI

InChI=1S/C15H17BrN2OS/c1-2-6-17-15(19)12-7-13-14(11(16)9-20-13)18(12)8-10-4-3-5-10/h2,7,9-10H,1,3-6,8H2,(H,17,19)

InChI Key

UPNVQGSUDJDEOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19896954

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.28

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.606

Distribution Coefficient, logD

3.606

Water Solubility, LogSw

-3.84

Polar Surface Area

26.536

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

-4.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V016-5956 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V016-5956 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-5956?
Check Price and Availability of V016-5956, 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 V016-5956 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-5956
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-5956
  • 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 V016-5956 available by request