Y200-2062 Screening compound: propyl 2-cyclobutaneamido-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate

Y200-2062 Screening compound: propyl 2-cyclobutaneamido-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
Y200-2062 Screening compound: propyl 2-cyclobutaneamido-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-2062
propyl 2-cyclobutaneamido-4-(3,4-dimethoxyphenyl)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

Y200-2062

Molecular Formula

C21H25NO5S (C21 H25 NO5 S)

Compound Name

propyl 2-cyclobutaneamido-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate

IUPAC name

propyl 2-cyclobutaneamido-4-(34-dimethoxyphenyl)thiophene-3-carboxylate

SMILES

CCCOC(c1c(NC(C2CCC2)=O)scc1-c(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C21H25NO5S/c1-4-10-27-21(24)18-15(14-8-9-16(25-2)17(11-14)26-3)12-28-20(18)22-19(23)13-6-5-7-13/h8-9,11-13H,4-7,10H2,1-3H3,(H,22,23)

InChI Key

MODUJFMGZRMVHB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02607711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.481

Distribution Coefficient, logD

3.444

Water Solubility, LogSw

-3.79

Polar Surface Area

59.684

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

-7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

Y200-2062 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y200-2062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-2062?
Check Price and Availability of Y200-2062, 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 Y200-2062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-2062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-2062
  • 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 Y200-2062 available by request