C060-0007 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide

C060-0007 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide
C060-0007 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C060-0007
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide

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

C060-0007

Molecular Formula

C22H30N4O3S (C22 H30 N4 O3 S)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(2-{56-dimethyl-4-oxo-3H4H-thieno[23-d]pyrimidin-3-yl}acetamido)butanamide

SMILES

Cc1c(C)sc(N=CN2CC(NCCCC(NCCC3=CCCCC3)=O)=O)c1C2=O

InChI

InChI=1S/C22H30N4O3S/c1-15-16(2)30-21-20(15)22(29)26(14-25-21)13-19(28)23-11-6-9-18(27)24-12-10-17-7-4-3-5-8-17/h7,14H,3-6,8-13H2,1-2H3,(H,23,28)(H,24,27)

InChI Key

HOUMJAXZNOZJGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14714193

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.360

Distribution Coefficient, logD

1.360

Water Solubility, LogSw

-1.92

Polar Surface Area

75.059

Acid Dissociation Constant (pKa)

15.05

Base Dissociation Constant (pKb)

4.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

References: we are preparing a list of scientific research reports with C060-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C060-0007?
Check Price and Availability of C060-0007, 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 C060-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C060-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C060-0007
  • 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 C060-0007 available by request