0632-0884 Screening compound: 3-(5-nitro-1H-1,3-benzodiazol-2-yl)propan-1-amine

0632-0884 Screening compound: 3-(5-nitro-1H-1,3-benzodiazol-2-yl)propan-1-amine
0632-0884 Screening compound: 3-(5-nitro-1H-1,3-benzodiazol-2-yl)propan-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0632-0884
3-(5-nitro-1H-1,3-benzodiazol-2-yl)propan-1-amine

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

0632-0884

Molecular Formula

C10H12N4O2 (C10 H12 N4 O2)

Compound Name

3-(5-nitro-1H-1,3-benzodiazol-2-yl)propan-1-amine

IUPAC name

n/a

SMILES

NCCCc1nc(cc(cc2)[N+]([O-])=O)c2[nH]1

InChI

InChI=1S/C10H12N4O2/c11-5-1-2-10-12-8-4-3-7(14(15)16)6-9(8)13-10/h3-4,6H,1-2,5,11H2,(H,12,13)

InChI Key

RWHXWZWPKVTAGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00448614

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

220.23

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.073

Distribution Coefficient, logD

-1.635

Water Solubility, LogSw

-2.24

Polar Surface Area

75.057

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

10.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

0632-0884 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0632-0884 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0632-0884?
Check Price and Availability of 0632-0884, 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 0632-0884 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0632-0884
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0632-0884
  • 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 0632-0884 available by request