F129-0129 Screening compound: methyl 3-({[4-(ethylamino)-2-oxo-2H-chromen-3-yl]carbamoyl}amino)thiophene-2-carboxylate

F129-0129 Screening compound: methyl 3-({[4-(ethylamino)-2-oxo-2H-chromen-3-yl]carbamoyl}amino)thiophene-2-carboxylate
F129-0129 Screening compound: methyl 3-({[4-(ethylamino)-2-oxo-2H-chromen-3-yl]carbamoyl}amino)thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F129-0129
methyl 3-({[4-(ethylamino)-2-oxo-2H-chromen-3-yl]carbamoyl}amino)thiophene-2-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

F129-0129

Molecular Formula

C18H17N3O5S (C18 H17 N3 O5 S)

Compound Name

methyl 3-({[4-(ethylamino)-2-oxo-2H-chromen-3-yl]carbamoyl}amino)thiophene-2-carboxylate

IUPAC name

methyl 3-({[4-(ethylamino)-2-oxo-2H-chromen-3-yl]carbamoyl}amino)thiophene-2-carboxylate

SMILES

CCNC(c(cccc1)c1OC1=O)=C1NC(Nc1c(C(OC)=O)scc1)=O

InChI

InChI=1S/C18H17N3O5S/c1-3-19-13-10-6-4-5-7-12(10)26-16(22)14(13)21-18(24)20-11-8-9-27-15(11)17(23)25-2/h4-9,19H,3H2,1-2H3,(H2,20,21,24)

InChI Key

NCXOENKJKDTRAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27103516

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.290

Distribution Coefficient, logD

2.279

Water Solubility, LogSw

-3.06

Polar Surface Area

85.487

Acid Dissociation Constant (pKa)

9.00

Base Dissociation Constant (pKb)

-5.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

F129-0129 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F129-0129 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F129-0129?
Check Price and Availability of F129-0129, 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 F129-0129 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F129-0129
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F129-0129
  • 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 F129-0129 available by request