8610-0615 Screening compound: 4-benzyl-7-(dibutylamino)-5,8-difluoro-3,4-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazine-1,1(2H)-dione

8610-0615 Screening compound: 4-benzyl-7-(dibutylamino)-5,8-difluoro-3,4-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazine-1,1(2H)-dione
8610-0615 Screening compound: 4-benzyl-7-(dibutylamino)-5,8-difluoro-3,4-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazine-1,1(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8610-0615
4-benzyl-7-(dibutylamino)-5,8-difluoro-3,4-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazine-1,1(2H)-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

8610-0615

Molecular Formula

C22H29F2N3O2S (C22 H29 F2 N3 O2 S)

Compound Name

4-benzyl-7-(dibutylamino)-5,8-difluoro-3,4-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazine-1,1(2H)-dione

IUPAC name

4-benzyl-7-(dibutylamino)-58-difluoro-2H3H4H-1lambda6-pyrido[43-b][14]thiazine-11-dione

SMILES

CCCCN(CCCC)c(c(F)c12)nc(F)c2N(Cc2ccccc2)CCS1(=O)=O

InChI

InChI=1S/C22H29F2N3O2S/c1-3-5-12-26(13-6-4-2)22-18(23)20-19(21(24)25-22)27(14-15-30(20,28)29)16-17-10-8-7-9-11-17/h7-11H,3-6,12-16H2,1-2H3

InChI Key

GSYKYHISKRTXPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08053410

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.435

Distribution Coefficient, logD

5.435

Water Solubility, LogSw

-5.25

Polar Surface Area

46.928

Acid Dissociation Constant (pKa)

21.39

Base Dissociation Constant (pKb)

1.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

8610-0615 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8610-0615 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8610-0615?
Check Price and Availability of 8610-0615, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8610-0615 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8610-0615
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8610-0615
  • 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 8610-0615 available by request