G508-0102 Screening compound: 2-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1lambda~6~,2-thiazinane-1,1-dione

G508-0102 Screening compound: 2-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1lambda~6~,2-thiazinane-1,1-dione
G508-0102 Screening compound: 2-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1lambda~6~,2-thiazinane-1,1-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound G508-0102
2-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1lambda~6~,2-thiazinane-1,1-dione

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

G508-0102

Molecular Formula

C18H20N2O4S2 (C18 H20 N2 O4 S2)

Compound Name

2-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1lambda~6~,2-thiazinane-1,1-dione

IUPAC name

2-[4-(23-dihydro-1H-indole-1-sulfonyl)phenyl]-1lambda62-thiazinane-11-dione

SMILES

O=S(c(cc1)ccc1N(CCCC1)S1(=O)=O)(N(CC1)c2c1cccc2)=O

InChI

InChI=1S/C18H20N2O4S2/c21-25(22)14-4-3-12-19(25)16-7-9-17(10-8-16)26(23,24)20-13-11-15-5-1-2-6-18(15)20/h1-2,5-10H,3-4,11-14H2

InChI Key

LZGGLVDNFURYEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08007670

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.219

Distribution Coefficient, logD

2.219

Water Solubility, LogSw

-2.50

Polar Surface Area

63.426

Acid Dissociation Constant (pKa)

21.69

Base Dissociation Constant (pKb)

-9.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G508-0102 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 G508-0102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G508-0102?
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What is the minimum amount of G508-0102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G508-0102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G508-0102
  • 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 G508-0102 available by request