C174-1013 Screening compound: N-[1-(1-pentyl-1H-1,3-benzodiazol-2-yl)pentyl]acetamide

C174-1013 Screening compound: N-[1-(1-pentyl-1H-1,3-benzodiazol-2-yl)pentyl]acetamide
C174-1013 Screening compound: N-[1-(1-pentyl-1H-1,3-benzodiazol-2-yl)pentyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C174-1013
N-[1-(1-pentyl-1H-1,3-benzodiazol-2-yl)pentyl]acetamide

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

C174-1013

Molecular Formula

C19H29N3O (C19 H29 N3 O)

Compound Name

N-[1-(1-pentyl-1H-1,3-benzodiazol-2-yl)pentyl]acetamide

IUPAC name

N-[1-(1-pentyl-1H-13-benzodiazol-2-yl)pentyl]acetamide

SMILES

CCCCCn1c(cccc2)c2nc1C(CCCC)NC(C)=O

InChI

InChI=1S/C19H29N3O/c1-4-6-10-14-22-18-13-9-8-12-16(18)21-19(22)17(11-7-5-2)20-15(3)23/h8-9,12-13,17H,4-7,10-11,14H2,1-3H3,(H,20,23)/t17-/m0/s1

InChI Key

GJBAORMQCXCCHO-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD04459352

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.845

Distribution Coefficient, logD

4.845

Water Solubility, LogSw

-4.45

Polar Surface Area

34.631

Acid Dissociation Constant (pKa)

11.95

Base Dissociation Constant (pKb)

4.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.90

C174-1013 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with C174-1013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C174-1013?
Check Price and Availability of C174-1013, 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 C174-1013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C174-1013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C174-1013
  • 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 C174-1013 available by request