4364-0630 Screening compound: 6'-[4-(dimethylamino)phenyl]-3-methyl-2,3,4,6-tetrahydrospiro[[1,3]thiazolo[3,2-a][1,3,5]triazine-7,3'-[1,5]dioxan]-6-one

4364-0630 Screening compound: 6'-[4-(dimethylamino)phenyl]-3-methyl-2,3,4,6-tetrahydrospiro[[1,3]thiazolo[3,2-a][1,3,5]triazine-7,3'-[1,5]dioxan]-6-one
4364-0630 Screening compound: 6'-[4-(dimethylamino)phenyl]-3-methyl-2,3,4,6-tetrahydrospiro[[1,3]thiazolo[3,2-a][1,3,5]triazine-7,3'-[1,5]dioxan]-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4364-0630
6'-[4-(dimethylamino)phenyl]-3-methyl-2,3,4,6-tetrahydrospiro[[1,3]thiazolo[3,2-a][1,3,5]triazine-7,3'-[1,5]dioxan]-6-one

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

4364-0630

Molecular Formula

C17H22N4O3S (C17 H22 N4 O3 S)

Compound Name

6'-[4-(dimethylamino)phenyl]-3-methyl-2,3,4,6-tetrahydrospiro[[1,3]thiazolo[3,2-a][1,3,5]triazine-7,3'-[1,5]dioxan]-6-one

IUPAC name

6'-[4-(dimethylamino)phenyl]-3-methyl-2346-tetrahydrospiro[[13]thiazolo[32-a][135]triazine-73'-[15]dioxan]-6-one

SMILES

CN(C)c1ccc(C(OC2)OCC22SC3=NCN(C)CN3C2=O)cc1

InChI

InChI=1S/C17H22N4O3S/c1-19(2)13-6-4-12(5-7-13)14-23-8-17(9-24-14)15(22)21-11-20(3)10-18-16(21)25-17/h4-7,14H,8-11H2,1-3H3

InChI Key

APNPHQJEEDHDLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03043765

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.048

Distribution Coefficient, logD

-0.906

Water Solubility, LogSw

-2.50

Polar Surface Area

49.939

Acid Dissociation Constant (pKa)

26.65

Base Dissociation Constant (pKb)

10.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.90

4364-0630 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4364-0630 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4364-0630?
Check Price and Availability of 4364-0630, 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 4364-0630 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4364-0630
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4364-0630
  • 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 4364-0630 available by request