6383-0906 Screening compound: N-[(4-bromophenyl)methyl]-1-pentyl-1H-1,3-benzodiazol-2-amine

6383-0906 Screening compound: N-[(4-bromophenyl)methyl]-1-pentyl-1H-1,3-benzodiazol-2-amine
6383-0906 Screening compound: N-[(4-bromophenyl)methyl]-1-pentyl-1H-1,3-benzodiazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6383-0906
N-[(4-bromophenyl)methyl]-1-pentyl-1H-1,3-benzodiazol-2-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

6383-0906

Molecular Formula

C19H22BrN3 (C19 H22 BrN3)

Compound Name

N-[(4-bromophenyl)methyl]-1-pentyl-1H-1,3-benzodiazol-2-amine

IUPAC name

N-[(4-bromophenyl)methyl]-1-pentyl-1H-13-benzodiazol-2-amine

SMILES

CCCCCn1c(NCc(cc2)ccc2Br)nc2c1cccc2

InChI

InChI=1S/C19H22BrN3/c1-2-3-6-13-23-18-8-5-4-7-17(18)22-19(23)21-14-15-9-11-16(20)12-10-15/h4-5,7-12H,2-3,6,13-14H2,1H3,(H,21,22)

InChI Key

IHPJRQACSJEJTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05625856

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.31

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.031

Distribution Coefficient, logD

5.998

Water Solubility, LogSw

-5.65

Polar Surface Area

22.559

Acid Dissociation Constant (pKa)

18.98

Base Dissociation Constant (pKb)

6.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

6383-0906 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 6383-0906 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6383-0906?
Check Price and Availability of 6383-0906, 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 6383-0906 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6383-0906
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6383-0906
  • 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 6383-0906 available by request