1300-0275 Screening compound: N,N-bis(2-cyanoethyl)-2,5-dimethylbenzene-1-sulfonamide

1300-0275 Screening compound: N,N-bis(2-cyanoethyl)-2,5-dimethylbenzene-1-sulfonamide
1300-0275 Screening compound: N,N-bis(2-cyanoethyl)-2,5-dimethylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1300-0275
N,N-bis(2-cyanoethyl)-2,5-dimethylbenzene-1-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

1300-0275

Molecular Formula

C14H17N3O2S (C14 H17 N3 O2 S)

Compound Name

N,N-bis(2-cyanoethyl)-2,5-dimethylbenzene-1-sulfonamide

IUPAC name

NN-bis(2-cyanoethyl)-25-dimethylbenzene-1-sulfonamide

SMILES

Cc1cc(S(N(CCC#N)CCC#N)(=O)=O)c(C)cc1

InChI

InChI=1S/C14H17N3O2S/c1-12-5-6-13(2)14(11-12)20(18,19)17(9-3-7-15)10-4-8-16/h5-6,11H,3-4,9-10H2,1-2H3

InChI Key

SGYIAQFHOAFMSH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00428315

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

291.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.644

Distribution Coefficient, logD

1.644

Water Solubility, LogSw

-2.27

Polar Surface Area

66.826

Acid Dissociation Constant (pKa)

22.00

Base Dissociation Constant (pKb)

-4.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with 1300-0275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1300-0275?
Check Price and Availability of 1300-0275, 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 1300-0275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1300-0275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1300-0275
  • 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 1300-0275 available by request