8015-9933 Screening compound: 3-butyl-2-(butylimino)-N~6~-(4-fluorophenyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide

8015-9933 Screening compound: 3-butyl-2-(butylimino)-N~6~-(4-fluorophenyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide
8015-9933 Screening compound: 3-butyl-2-(butylimino)-N~6~-(4-fluorophenyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-9933
3-butyl-2-(butylimino)-N~6~-(4-fluorophenyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide

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

8015-9933

Molecular Formula

C19H24FN3O2S (C19 H24 FN3 O2 S)

Compound Name

3-butyl-2-(butylimino)-N~6~-(4-fluorophenyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide

IUPAC name

n/a

SMILES

CCCCN(C(C=C(C(Nc(cc1)ccc1F)=O)S1)=O)/C1=N\CCCC

InChI

InChI=1S/C19H24FN3O2S/c1-3-5-11-21-19-23(12-6-4-2)17(24)13-16(26-19)18(25)22-15-9-7-14(20)8-10-15/h7-10,13H,3-6,11-12H2,1-2H3,(H,22,25)

InChI Key

HKLLUMFOTWKWJZ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

377.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.628

Distribution Coefficient, logD

4.624

Water Solubility, LogSw

-4.16

Polar Surface Area

49.020

Acid Dissociation Constant (pKa)

9.54

Base Dissociation Constant (pKb)

4.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with 8015-9933 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-9933?
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What is the minimum amount of 8015-9933 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-9933
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-9933
  • 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 8015-9933 available by request