Y204-3688 Screening compound: 4-cyano-N~2~-(2-methoxyphenyl)-3-methyl-5-[(4-phenylbutanoyl)amino]-2-thiophenecarboxamide

Y204-3688 Screening compound: 4-cyano-N~2~-(2-methoxyphenyl)-3-methyl-5-[(4-phenylbutanoyl)amino]-2-thiophenecarboxamide
Y204-3688 Screening compound: 4-cyano-N~2~-(2-methoxyphenyl)-3-methyl-5-[(4-phenylbutanoyl)amino]-2-thiophenecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y204-3688
4-cyano-N~2~-(2-methoxyphenyl)-3-methyl-5-[(4-phenylbutanoyl)amino]-2-thiophenecarboxamide

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

Y204-3688

Molecular Formula

C24H23N3O3S (C24 H23 N3 O3 S)

Compound Name

4-cyano-N~2~-(2-methoxyphenyl)-3-methyl-5-[(4-phenylbutanoyl)amino]-2-thiophenecarboxamide

IUPAC name

4-cyano-N-(2-methoxyphenyl)-3-methyl-5-(4-phenylbutanamido)thiophene-2-carboxamide

SMILES

Cc1c(C(Nc(cccc2)c2OC)=O)sc(NC(CCCc2ccccc2)=O)c1C#N

InChI

InChI=1S/C24H23N3O3S/c1-16-18(15-25)24(27-21(28)14-8-11-17-9-4-3-5-10-17)31-22(16)23(29)26-19-12-6-7-13-20(19)30-2/h3-7,9-10,12-13H,8,11,14H2,1-2H3,(H,26,29)(H,27,28)

InChI Key

UWOZTIRSWDINGP-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.556

Distribution Coefficient, logD

1.548

Water Solubility, LogSw

-4.64

Polar Surface Area

69.991

Acid Dissociation Constant (pKa)

4.39

Base Dissociation Constant (pKb)

0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.83

Y204-3688 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 Y204-3688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y204-3688?
Check Price and Availability of Y204-3688, 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 Y204-3688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y204-3688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y204-3688
  • 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 Y204-3688 available by request