G938-1022 Screening compound: 2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[4-(1,2-oxazol-5-yl)phenyl]acetamide

G938-1022 Screening compound: 2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[4-(1,2-oxazol-5-yl)phenyl]acetamide
G938-1022 Screening compound: 2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[4-(1,2-oxazol-5-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G938-1022
2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[4-(1,2-oxazol-5-yl)phenyl]acetamide

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

G938-1022

Molecular Formula

C20H17ClN4O6S (C20 H17 ClN4 O6 S)

Compound Name

2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[4-(1,2-oxazol-5-yl)phenyl]acetamide

IUPAC name

2-(N-methyl6-chloro-3-oxo-34-dihydro-2H-14-benzoxazine-7-sulfonamido)-N-[4-(12-oxazol-5-yl)phenyl]acetamide

SMILES

CN(CC(Nc(cc1)ccc1-c1ccno1)=O)S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O

InChI

InChI=1S/C20H17ClN4O6S/c1-25(10-19(26)23-13-4-2-12(3-5-13)16-6-7-22-31-16)32(28,29)18-9-17-15(8-14(18)21)24-20(27)11-30-17/h2-9H,10-11H2,1H3,(H,23,26)(H,24,27)

InChI Key

ZPIYLUFASWPBME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27168427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.9

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.786

Distribution Coefficient, logD

1.728

Water Solubility, LogSw

-3.08

Polar Surface Area

111.091

Acid Dissociation Constant (pKa)

8.24

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

G938-1022 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G938-1022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G938-1022?
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What is the minimum amount of G938-1022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G938-1022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G938-1022
  • 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 G938-1022 available by request