5044-0011 Screening compound: N-[5-(2-HYDROXYETHYL)-1,3,5-TRIAZINAN-2-YLIDENE]BUTANE-1-SULFONAMIDE

5044-0011 Screening compound: N-[5-(2-HYDROXYETHYL)-1,3,5-TRIAZINAN-2-YLIDENE]BUTANE-1-SULFONAMIDE
5044-0011 Screening compound: N-[5-(2-HYDROXYETHYL)-1,3,5-TRIAZINAN-2-YLIDENE]BUTANE-1-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 5044-0011
N-[5-(2-HYDROXYETHYL)-1,3,5-TRIAZINAN-2-YLIDENE]BUTANE-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

5044-0011

Molecular Formula

C9H20N4O3S (C9 H20 N4 O3 S)

Compound Name

N-[5-(2-HYDROXYETHYL)-1,3,5-TRIAZINAN-2-YLIDENE]BUTANE-1-SULFONAMIDE

IUPAC name

n/a

SMILES

CCCCS(N=C1NCN(CCO)CN1)(=O)=O

InChI

InChI=1S/C9H20N4O3S/c1-2-3-6-17(15,16)12-9-10-7-13(4-5-14)8-11-9/h14H,2-8H2,1H3,(H2,10,11,12)

InChI Key

HJEZOROETXMPNW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03195898

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.534

Distribution Coefficient, logD

-1.601

Water Solubility, LogSw

-1.22

Polar Surface Area

82.531

Acid Dissociation Constant (pKa)

14.97

Base Dissociation Constant (pKb)

8.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

88.90

References: we are preparing a list of scientific research reports with 5044-0011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5044-0011?
Check Price and Availability of 5044-0011, 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 5044-0011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5044-0011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5044-0011
  • 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 5044-0011 available by request