L310-0574 Screening compound: 6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-(4-fluoro-2-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide

L310-0574 Screening compound: 6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-(4-fluoro-2-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
L310-0574 Screening compound: 6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-(4-fluoro-2-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L310-0574
6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-(4-fluoro-2-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide

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

L310-0574

Molecular Formula

C20H18ClFN4O5S (C20 H18 ClFN4 O5 S)

Compound Name

6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-(4-fluoro-2-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide

IUPAC name

6-chloro-4-[(5-ethyl-124-oxadiazol-3-yl)methyl]-N-(4-fluoro-2-methylphenyl)-3-oxo-34-dihydro-2H-14-benzoxazine-7-sulfonamide

SMILES

CCc1nc(CN(C(COc2c3)=O)c2cc(Cl)c3S(Nc(cc2)c(C)cc2F)(=O)=O)no1

InChI

InChI=1S/C20H18ClFN4O5S/c1-3-19-23-18(24-31-19)9-26-15-7-13(21)17(8-16(15)30-10-20(26)27)32(28,29)25-14-5-4-12(22)6-11(14)2/h4-8,25H,3,9-10H2,1-2H3

InChI Key

MIBHOVALABWPOE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27244345

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.9

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.254

Distribution Coefficient, logD

3.183

Water Solubility, LogSw

-3.43

Polar Surface Area

96.625

Acid Dissociation Constant (pKa)

8.15

Base Dissociation Constant (pKb)

-4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

L310-0574 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 L310-0574 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L310-0574?
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What is the minimum amount of L310-0574 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L310-0574
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L310-0574
  • 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 L310-0574 available by request