6641-0220 Screening compound: tert-butyl N-(2-{[2-(1H-1,3-benzimidazol-2-yl)ethyl]amino}-2-oxoethyl)carbamate

6641-0220 Screening compound: tert-butyl N-(2-{[2-(1H-1,3-benzimidazol-2-yl)ethyl]amino}-2-oxoethyl)carbamate
6641-0220 Screening compound: tert-butyl N-(2-{[2-(1H-1,3-benzimidazol-2-yl)ethyl]amino}-2-oxoethyl)carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6641-0220
tert-butyl N-(2-{[2-(1H-1,3-benzimidazol-2-yl)ethyl]amino}-2-oxoethyl)carbamate

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

6641-0220

Molecular Formula

C16H22N4O3 (C16 H22 N4 O3)

Compound Name

tert-butyl N-(2-{[2-(1H-1,3-benzimidazol-2-yl)ethyl]amino}-2-oxoethyl)carbamate

IUPAC name

tert-butyl N-({[2-(1H-13-benzodiazol-2-yl)ethyl]carbamoyl}methyl)carbamate

SMILES

CC(C)(C)OC(NCC(NCCc1nc(cccc2)c2[nH]1)=O)=O

InChI

InChI=1S/C16H22N4O3/c1-16(2,3)23-15(22)18-10-14(21)17-9-8-13-19-11-6-4-5-7-12(11)20-13/h4-7H,8-10H2,1-3H3,(H,17,21)(H,18,22)(H,19,20)

InChI Key

DPKNVLUQOKEPKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14711797

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.399

Distribution Coefficient, logD

2.386

Water Solubility, LogSw

-2.71

Polar Surface Area

76.708

Acid Dissociation Constant (pKa)

13.46

Base Dissociation Constant (pKb)

5.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.75

References: we are preparing a list of scientific research reports with 6641-0220 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6641-0220?
Check Price and Availability of 6641-0220, 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 6641-0220 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6641-0220
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6641-0220
  • 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 6641-0220 available by request