Y041-5103 Screening compound: 2-[(5-methoxy-1-methyl-1H-indol-2-yl)formamido]-N-(5-methyl-1,3-thiazol-2-yl)-4-(methylsulfanyl)butanamide

Y041-5103 Screening compound: 2-[(5-methoxy-1-methyl-1H-indol-2-yl)formamido]-N-(5-methyl-1,3-thiazol-2-yl)-4-(methylsulfanyl)butanamide
Y041-5103 Screening compound: 2-[(5-methoxy-1-methyl-1H-indol-2-yl)formamido]-N-(5-methyl-1,3-thiazol-2-yl)-4-(methylsulfanyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-5103
2-[(5-methoxy-1-methyl-1H-indol-2-yl)formamido]-N-(5-methyl-1,3-thiazol-2-yl)-4-(methylsulfanyl)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

Y041-5103

Molecular Formula

C20H24N4O3S2 (C20 H24 N4 O3 S2)

Compound Name

2-[(5-methoxy-1-methyl-1H-indol-2-yl)formamido]-N-(5-methyl-1,3-thiazol-2-yl)-4-(methylsulfanyl)butanamide

IUPAC name

(2R)-2-[(5-methoxy-1-methyl-1H-indol-2-yl)formamido]-N-(5-methyl-13-thiazol-2-yl)-4-(methylsulfanyl)butanamide

SMILES

Cc1cnc(NC([C@@H](CCSC)NC(c2cc(cc(cc3)OC)c3n2C)=O)=O)s1

InChI

InChI=1S/C20H24N4O3S2/c1-12-11-21-20(29-12)23-18(25)15(7-8-28-4)22-19(26)17-10-13-9-14(27-3)5-6-16(13)24(17)2/h5-6,9-11,15H,7-8H2,1-4H3,(H,22,26)(H,21,23,25)/t15-/m1/s1

InChI Key

KWAKLNOYCLXEQM-OAHLLOKOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.301

Distribution Coefficient, logD

4.290

Water Solubility, LogSw

-4.17

Polar Surface Area

67.292

Acid Dissociation Constant (pKa)

9.02

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

Y041-5103 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y041-5103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-5103?
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What is the minimum amount of Y041-5103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-5103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-5103
  • 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 Y041-5103 available by request