V014-9752 Screening compound: 1-[4-(4-methoxybenzoyl)-1-thia-4,8-diazaspiro[4.5]dec-8-yl]-1-dodecanone

V014-9752 Screening compound: 1-[4-(4-methoxybenzoyl)-1-thia-4,8-diazaspiro[4.5]dec-8-yl]-1-dodecanone
V014-9752 Screening compound: 1-[4-(4-methoxybenzoyl)-1-thia-4,8-diazaspiro[4.5]dec-8-yl]-1-dodecanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-9752
1-[4-(4-methoxybenzoyl)-1-thia-4,8-diazaspiro[4.5]dec-8-yl]-1-dodecanone

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

V014-9752

Molecular Formula

C27H42N2O3S (C27 H42 N2 O3 S)

Compound Name

1-[4-(4-methoxybenzoyl)-1-thia-4,8-diazaspiro[4.5]dec-8-yl]-1-dodecanone

IUPAC name

1-[4-(4-methoxybenzoyl)-1-thia-48-diazaspiro[4.5]decan-8-yl]dodecan-1-one

SMILES

CCCCCCCCCCCC(N(CC1)CCC11SCCN1C(c(cc1)ccc1OC)=O)=O

InChI

InChI=1S/C27H42N2O3S/c1-3-4-5-6-7-8-9-10-11-12-25(30)28-19-17-27(18-20-28)29(21-22-33-27)26(31)23-13-15-24(32-2)16-14-23/h13-16H,3-12,17-22H2,1-2H3

InChI Key

DLDOSCXELRPYNB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14244870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.71

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.238

Distribution Coefficient, logD

6.238

Water Solubility, LogSw

-5.29

Polar Surface Area

40.400

Acid Dissociation Constant (pKa)

24.47

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

70.37

References: we are preparing a list of scientific research reports with V014-9752 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-9752?
Check Price and Availability of V014-9752, 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 V014-9752 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-9752
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-9752
  • 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 V014-9752 available by request