V007-1949 Screening compound: ethyl 2-(2-methylbutanamido)-5-(6-methylhept-5-en-2-yl)thiophene-3-carboxylate

V007-1949 Screening compound: ethyl 2-(2-methylbutanamido)-5-(6-methylhept-5-en-2-yl)thiophene-3-carboxylate
V007-1949 Screening compound: ethyl 2-(2-methylbutanamido)-5-(6-methylhept-5-en-2-yl)thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-1949
ethyl 2-(2-methylbutanamido)-5-(6-methylhept-5-en-2-yl)thiophene-3-carboxylate

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

V007-1949

Molecular Formula

C20H31NO3S (C20 H31 NO3 S)

Compound Name

ethyl 2-(2-methylbutanamido)-5-(6-methylhept-5-en-2-yl)thiophene-3-carboxylate

IUPAC name

ethyl 2-(2-methylbutanamido)-5-[(2S)-6-methylhept-5-en-2-yl]thiophene-3-carboxylate

SMILES

CCC(C)C(Nc(sc(C(C)CCC=C(C)C)c1)c1C(OCC)=O)=O

InChI

InChI=1S/C20H31NO3S/c1-7-14(5)18(22)21-19-16(20(23)24-8-2)12-17(25-19)15(6)11-9-10-13(3)4/h10,12,14-15H,7-9,11H2,1-6H3,(H,21,22)/t14?,15-/m0/s1

InChI Key

ZOTYYUACQLCEEX-LOACHALJSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.996

Distribution Coefficient, logD

4.485

Water Solubility, LogSw

-5.41

Polar Surface Area

44.149

Acid Dissociation Constant (pKa)

5.90

Base Dissociation Constant (pKb)

-5.02

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

60.00

V007-1949 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V007-1949 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-1949?
Check Price and Availability of V007-1949, 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 V007-1949 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-1949
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-1949
  • 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 V007-1949 available by request