D011-5307 Screening compound: N-(3-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}propyl)butanamide

D011-5307 Screening compound: N-(3-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}propyl)butanamide
D011-5307 Screening compound: N-(3-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}propyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D011-5307
N-(3-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}propyl)butanamide

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

D011-5307

Molecular Formula

C21H24ClN3O (C21 H24 ClN3 O)

Compound Name

N-(3-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}propyl)butanamide

IUPAC name

N-(3-{1-[(2-chlorophenyl)methyl]-1H-13-benzodiazol-2-yl}propyl)butanamide

SMILES

CCCC(NCCCc1nc(cccc2)c2n1Cc(cccc1)c1Cl)=O

InChI

InChI=1S/C21H24ClN3O/c1-2-8-21(26)23-14-7-13-20-24-18-11-5-6-12-19(18)25(20)15-16-9-3-4-10-17(16)22/h3-6,9-12H,2,7-8,13-15H2,1H3,(H,23,26)

InChI Key

UNOPFBAQNVLCDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07414036

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.89

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.364

Distribution Coefficient, logD

4.361

Water Solubility, LogSw

-4.31

Polar Surface Area

35.456

Acid Dissociation Constant (pKa)

14.91

Base Dissociation Constant (pKb)

5.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with D011-5307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D011-5307?
Check Price and Availability of D011-5307, 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 D011-5307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D011-5307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D011-5307
  • 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 D011-5307 available by request