G938-0899 Screening compound: 2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[(oxolan-2-yl)methyl]acetamide

G938-0899 Screening compound: 2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[(oxolan-2-yl)methyl]acetamide
G938-0899 Screening compound: 2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[(oxolan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G938-0899
2-(N-methyl6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamido)-N-[(oxolan-2-yl)methyl]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

G938-0899

Molecular Formula

C16H20ClN3O6S (C16 H20 ClN3 O6 S)

Compound Name

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

IUPAC name

2-(N-methyl6-chloro-3-oxo-34-dihydro-2H-14-benzoxazine-7-sulfonamido)-N-[(oxolan-2-yl)methyl]acetamide

SMILES

CN(CC(NCC1OCCC1)=O)S(c(cc(c(N1)c2)OCC1=O)c2Cl)(=O)=O

InChI

InChI=1S/C16H20ClN3O6S/c1-20(8-15(21)18-7-10-3-2-4-25-10)27(23,24)14-6-13-12(5-11(14)17)19-16(22)9-26-13/h5-6,10H,2-4,7-9H2,1H3,(H,18,21)(H,19,22)/t10-/m1/s1

InChI Key

STGLWOZKVZHISK-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD27168407

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.87

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.048

Distribution Coefficient, logD

-0.107

Water Solubility, LogSw

-2.86

Polar Surface Area

99.199

Acid Dissociation Constant (pKa)

8.24

Base Dissociation Constant (pKb)

-1.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

G938-0899 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G938-0899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G938-0899?
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What is the minimum amount of G938-0899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G938-0899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G938-0899
  • 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 G938-0899 available by request