8018-5236 Screening compound: 5-(3,4-diaminotetrahydro-2-thiophenyl)pentanoic acid

8018-5236 Screening compound: 5-(3,4-diaminotetrahydro-2-thiophenyl)pentanoic acid
8018-5236 Screening compound: 5-(3,4-diaminotetrahydro-2-thiophenyl)pentanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-5236
5-(3,4-diaminotetrahydro-2-thiophenyl)pentanoic acid

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

8018-5236

Molecular Formula

C9H18N2O2S (C9 H18 N2 O2 S)

Compound Name

5-(3,4-diaminotetrahydro-2-thiophenyl)pentanoic acid

IUPAC name

5-(34-diaminothiolan-2-yl)pentanoic acid

SMILES

NC(CSC1CCCCC(O)=O)C1N

InChI

InChI=1S/C9H18N2O2S/c10-6-5-14-7(9(6)11)3-1-2-4-8(12)13/h6-7,9H,1-5,10-11H2,(H,12,13)

InChI Key

JKNCSZDPWAVQAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01115291

Chemical and Physical Properties

Saltdata

2HBr

Molecular Weight

218.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

-1.182

Distribution Coefficient, logD

-1.182

Water Solubility, LogSw

-0.80

Polar Surface Area

69.702

Acid Dissociation Constant (pKa)

4.57

Base Dissociation Constant (pKb)

7.68

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

88.89

References: we are preparing a list of scientific research reports with 8018-5236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-5236?
Check Price and Availability of 8018-5236, 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 8018-5236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-5236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-5236
  • 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 8018-5236 available by request