F514-0507 Screening compound: 1-(3-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-3-oxopropyl)-N,N-dimethyl-1H-1,2,3-benzotriazole-5-sulfonamide

F514-0507 Screening compound: 1-(3-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-3-oxopropyl)-N,N-dimethyl-1H-1,2,3-benzotriazole-5-sulfonamide
F514-0507 Screening compound: 1-(3-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-3-oxopropyl)-N,N-dimethyl-1H-1,2,3-benzotriazole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F514-0507
1-(3-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-3-oxopropyl)-N,N-dimethyl-1H-1,2,3-benzotriazole-5-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

F514-0507

Molecular Formula

C18H25N5O5S (C18 H25 N5 O5 S)

Compound Name

1-(3-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-3-oxopropyl)-N,N-dimethyl-1H-1,2,3-benzotriazole-5-sulfonamide

IUPAC name

1-(3-{14-dioxa-8-azaspiro[4.5]decan-8-yl}-3-oxopropyl)-NN-dimethyl-1H-123-benzotriazole-5-sulfonamide

SMILES

CN(C)S(c(cc1)cc2c1n(CCC(N(CC1)CCC11OCCO1)=O)nn2)(=O)=O

InChI

InChI=1S/C18H25N5O5S/c1-21(2)29(25,26)14-3-4-16-15(13-14)19-20-23(16)8-5-17(24)22-9-6-18(7-10-22)27-11-12-28-18/h3-4,13H,5-12H2,1-2H3

InChI Key

LPXXIZPUZDSTPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27171528

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.49

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.109

Distribution Coefficient, logD

-0.109

Water Solubility, LogSw

-2.16

Polar Surface Area

90.136

Acid Dissociation Constant (pKa)

23.39

Base Dissociation Constant (pKb)

1.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

References: we are preparing a list of scientific research reports with F514-0507 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F514-0507?
Check Price and Availability of F514-0507, 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 F514-0507 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F514-0507
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F514-0507
  • 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 F514-0507 available by request