SB70-0062 Screening compound: (5S)-N-butyl-5-(dimethylamino)-N-ethyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide

SB70-0062 Screening compound: (5S)-N-butyl-5-(dimethylamino)-N-ethyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
SB70-0062 Screening compound: (5S)-N-butyl-5-(dimethylamino)-N-ethyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB70-0062
(5S)-N-butyl-5-(dimethylamino)-N-ethyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide

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

SB70-0062

Molecular Formula

C15H26N4O (C15 H26 N4 O)

Compound Name

(5S)-N-butyl-5-(dimethylamino)-N-ethyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide

IUPAC name

(5S)-N-butyl-5-(dimethylamino)-N-ethyl-4H5H6H-pyrrolo[12-b]pyrazole-2-carboxamide

SMILES

CCCCN(CC)C(c1nn(C[C@H](C2)N(C)C)c2c1)=O

InChI

InChI=1S/C15H26N4O/c1-5-7-8-18(6-2)15(20)14-10-12-9-13(17(3)4)11-19(12)16-14/h10,13H,5-9,11H2,1-4H3/t13-/m1/s1

InChI Key

KNURQCUVJXRNPE-CYBMUJFWSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

278.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.693

Distribution Coefficient, logD

1.316

Water Solubility, LogSw

-1.78

Polar Surface Area

32.899

Acid Dissociation Constant (pKa)

22.05

Base Dissociation Constant (pKb)

7.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

73.33

SB70-0062 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB70-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB70-0062?
Check Price and Availability of SB70-0062, 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 SB70-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB70-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB70-0062
  • 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 SB70-0062 available by request