SC77-0755 Screening compound: (4S,5S)-2-(methylsulfonyl)-4-[(4-propylpiperazino)carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one

SC77-0755 Screening compound: (4S,5S)-2-(methylsulfonyl)-4-[(4-propylpiperazino)carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one
SC77-0755 Screening compound: (4S,5S)-2-(methylsulfonyl)-4-[(4-propylpiperazino)carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SC77-0755
(4S,5S)-2-(methylsulfonyl)-4-[(4-propylpiperazino)carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one

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

SC77-0755

Molecular Formula

C16H28N4O5S (C16 H28 N4 O5 S)

Compound Name

(4S,5S)-2-(methylsulfonyl)-4-[(4-propylpiperazino)carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one

IUPAC name

(4S5S)-2-methanesulfonyl-4-(4-propylpiperazine-1-carbonyl)-6-oxa-29-diazaspiro[4.5]decan-10-one

SMILES

CCCN(CC1)CCN1C([C@H](CN(C1)S(C)(=O)=O)[C@@]11OCCNC1=O)=O

InChI

InChI=1S/C16H28N4O5S/c1-3-5-18-6-8-19(9-7-18)14(21)13-11-20(26(2,23)24)12-16(13)15(22)17-4-10-25-16/h13H,3-12H2,1-2H3,(H,17,22)/t13-,16+/m1/s1

InChI Key

FPJBZEJSDOHCPA-CJNGLKHVSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.49

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.882

Distribution Coefficient, logD

-1.333

Water Solubility, LogSw

-1.59

Polar Surface Area

85.299

Acid Dissociation Constant (pKa)

14.84

Base Dissociation Constant (pKb)

7.66

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

87.50

SC77-0755 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 SC77-0755 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC77-0755?
Check Price and Availability of SC77-0755, 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 SC77-0755 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC77-0755
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC77-0755
  • 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 SC77-0755 available by request