N121-0701 Screening compound: 4-[(1R

N121-0701 Screening compound: 4-[(1R
N121-0701 Screening compound: 4-[(1R alternative view

Chemical Structure Depiction of ChemDiv screening compound N121-0701
4-[(1R

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

N121-0701

Molecular Formula

C27H40N6O (C27 H40 N6 O)

Compound Name

4-[(1R

IUPAC name

n/a

SMILES

Cc1c(CNC(CCC[C@H]2N(Cc3cnccc3)C[C@H](CCC3)[C@@H]4N3CCC[C@H]24)=O)c(C)n[nH]1

InChI

InChI=1S/C27H40N6O/c1-19-24(20(2)31-30-19)16-29-26(34)11-3-10-25-23-9-6-14-32-13-5-8-22(27(23)32)18-33(25)17-21-7-4-12-28-15-21/h4,7,12,15,22-23,25,27H,3,5-6,8-11,13-14,16-18H2,1-2H3,(H,29,34)(H,30,31)/t22-,23-,25-,27-/m1/s1

InChI Key

GGISJDZDOZFZRA-JTOATPROSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.65

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.441

Distribution Coefficient, logD

0.231

Water Solubility, LogSw

-1.47

Polar Surface Area

64.075

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

8.58

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

66.70

N121-0701 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with N121-0701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N121-0701?
Check Price and Availability of N121-0701, 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 N121-0701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N121-0701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N121-0701
  • 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 N121-0701 available by request