Y207-2070 Screening compound: N~1~-(2,3-dihydro-1H-inden-5-yl)-4-(phenylsulfonyl)tetrahydro-1(2H)-pyrazinecarboxamide

Y207-2070 Screening compound: N~1~-(2,3-dihydro-1H-inden-5-yl)-4-(phenylsulfonyl)tetrahydro-1(2H)-pyrazinecarboxamide
Y207-2070 Screening compound: N~1~-(2,3-dihydro-1H-inden-5-yl)-4-(phenylsulfonyl)tetrahydro-1(2H)-pyrazinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y207-2070
N~1~-(2,3-dihydro-1H-inden-5-yl)-4-(phenylsulfonyl)tetrahydro-1(2H)-pyrazinecarboxamide

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

Y207-2070

Molecular Formula

C20H23N3O3S (C20 H23 N3 O3 S)

Compound Name

N~1~-(2,3-dihydro-1H-inden-5-yl)-4-(phenylsulfonyl)tetrahydro-1(2H)-pyrazinecarboxamide

IUPAC name

4-(benzenesulfonyl)-N-(23-dihydro-1H-inden-5-yl)piperazine-1-carboxamide

SMILES

O=C(Nc1cc(CCC2)c2cc1)N(CC1)CCN1S(c1ccccc1)(=O)=O

InChI

InChI=1S/C20H23N3O3S/c24-20(21-18-10-9-16-5-4-6-17(16)15-18)22-11-13-23(14-12-22)27(25,26)19-7-2-1-3-8-19/h1-3,7-10,15H,4-6,11-14H2,(H,21,24)

InChI Key

NSORPMWNQIGYPE-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.153

Distribution Coefficient, logD

3.153

Water Solubility, LogSw

-3.55

Polar Surface Area

57.513

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

2.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

Y207-2070 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 Y207-2070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y207-2070?
Check Price and Availability of Y207-2070, 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 Y207-2070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y207-2070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y207-2070
  • 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 Y207-2070 available by request