SB32-0703 Screening compound: (3S,4S)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(methoxymethyl)tetrahydro-1H-pyrrol-1-yl (8-quinolyl) sulfone

SB32-0703 Screening compound: (3S,4S)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(methoxymethyl)tetrahydro-1H-pyrrol-1-yl (8-quinolyl) sulfone
SB32-0703 Screening compound: (3S,4S)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(methoxymethyl)tetrahydro-1H-pyrrol-1-yl (8-quinolyl) sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB32-0703
(3S,4S)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(methoxymethyl)tetrahydro-1H-pyrrol-1-yl (8-quinolyl) sulfone

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

SB32-0703

Molecular Formula

C20H23N5O3S (C20 H23 N5 O3 S)

Compound Name

(3S,4S)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(methoxymethyl)tetrahydro-1H-pyrrol-1-yl (8-quinolyl) sulfone

IUPAC name

8-{[(3S4S)-3-(3-cyclopropyl-1H-124-triazol-5-yl)-4-(methoxymethyl)pyrrolidin-1-yl]sulfonyl}quinoline

SMILES

COC[C@@H](CN(C1)S(c2cccc3cccnc23)(=O)=O)[C@H]1c1nc(C2CC2)n[nH]1

InChI

InChI=1S/C20H23N5O3S/c1-28-12-15-10-25(11-16(15)20-22-19(23-24-20)14-7-8-14)29(26,27)17-6-2-4-13-5-3-9-21-18(13)17/h2-6,9,14-16H,7-8,10-12H2,1H3,(H,22,23,24)/t15-,16+/m0/s1

InChI Key

OSAASIOEJYIRNB-JKSUJKDBSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.059

Distribution Coefficient, logD

2.058

Water Solubility, LogSw

-2.50

Polar Surface Area

84.176

Acid Dissociation Constant (pKa)

8.42

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

45.00

SB32-0703 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB32-0703 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB32-0703?
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What is the minimum amount of SB32-0703 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB32-0703
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB32-0703
  • 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 SB32-0703 available by request