8002-7705 Screening compound: 5-(3-amino-5-methyl-4-nitro-2-thienyl)pentanoic acid

8002-7705 Screening compound: 5-(3-amino-5-methyl-4-nitro-2-thienyl)pentanoic acid
8002-7705 Screening compound: 5-(3-amino-5-methyl-4-nitro-2-thienyl)pentanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-7705
5-(3-amino-5-methyl-4-nitro-2-thienyl)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

8002-7705

Molecular Formula

C10H14N2O4S (C10 H14 N2 O4 S)

Compound Name

5-(3-amino-5-methyl-4-nitro-2-thienyl)pentanoic acid

IUPAC name

5-(3-amino-5-methyl-4-nitrothiophen-2-yl)pentanoic acid

SMILES

Cc(sc(CCCCC(O)=O)c1N)c1[N+]([O-])=O

InChI

InChI=1S/C10H14N2O4S/c1-6-10(12(15)16)9(11)7(17-6)4-2-3-5-8(13)14/h2-5,11H2,1H3,(H,13,14)

InChI Key

LYTHLEQGHLPJHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00738390

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.910

Distribution Coefficient, logD

-0.918

Water Solubility, LogSw

-1.90

Polar Surface Area

81.806

Acid Dissociation Constant (pKa)

4.57

Base Dissociation Constant (pKb)

-1.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 8002-7705 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-7705?
Check Price and Availability of 8002-7705, 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 8002-7705 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-7705
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-7705
  • 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 8002-7705 available by request