Y020-1354 Screening compound: 1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethan-1-one

Y020-1354 Screening compound: 1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethan-1-one
Y020-1354 Screening compound: 1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-1354
1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethan-1-one

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

Y020-1354

Molecular Formula

C18H17N5OS (C18 H17 N5 OS)

Compound Name

1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethan-1-one

IUPAC name

1-(2-methyl-23-dihydro-1H-indol-1-yl)-2-[(1-phenyl-1H-1234-tetrazol-5-yl)sulfanyl]ethan-1-one

SMILES

CC(C1)N(C(CSc2nnnn2-c2ccccc2)=O)c2c1cccc2

InChI

InChI=1S/C18H17N5OS/c1-13-11-14-7-5-6-10-16(14)22(13)17(24)12-25-18-19-20-21-23(18)15-8-3-2-4-9-15/h2-10,13H,11-12H2,1H3/t13-/m0/s1

InChI Key

GVDVCLSVHXYYLI-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD03477240

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.116

Distribution Coefficient, logD

3.116

Water Solubility, LogSw

-3.34

Polar Surface Area

54.251

Acid Dissociation Constant (pKa)

18.98

Base Dissociation Constant (pKb)

-0.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

Y020-1354 in Drug Discovery

Included in Screening Libraries

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y020-1354 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-1354?
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What is the minimum amount of Y020-1354 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-1354
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-1354
  • 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 Y020-1354 available by request