SB18-0930 Screening compound: N-[(3S,5S)-1-[(5-methyl-3-isoxazolyl)carbonyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]methanesulfonamide

SB18-0930 Screening compound: N-[(3S,5S)-1-[(5-methyl-3-isoxazolyl)carbonyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]methanesulfonamide
SB18-0930 Screening compound: N-[(3S,5S)-1-[(5-methyl-3-isoxazolyl)carbonyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB18-0930
N-[(3S,5S)-1-[(5-methyl-3-isoxazolyl)carbonyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]methanesulfonamide

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

SB18-0930

Molecular Formula

C18H20N6O4S (C18 H20 N6 O4 S)

Compound Name

N-[(3S,5S)-1-[(5-methyl-3-isoxazolyl)carbonyl]-5-(3-phenyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-3-yl]methanesulfonamide

IUPAC name

N-[(3S5S)-1-(5-methyl-12-oxazole-3-carbonyl)-5-(3-phenyl-1H-124-triazol-5-yl)pyrrolidin-3-yl]methanesulfonamide

SMILES

Cc1cc(C(N(C[C@H](C2)NS(C)(=O)=O)[C@@H]2c2nc(-c3ccccc3)n[nH]2)=O)no1

InChI

InChI=1S/C18H20N6O4S/c1-11-8-14(22-28-11)18(25)24-10-13(23-29(2,26)27)9-15(24)17-19-16(20-21-17)12-6-4-3-5-7-12/h3-8,13,15,23H,9-10H2,1-2H3,(H,19,20,21)/t13-,15+/m0/s1

InChI Key

YXQKAEDYTPSQHN-DZGCQCFKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.46

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.779

Distribution Coefficient, logD

1.773

Water Solubility, LogSw

-2.57

Polar Surface Area

114.344

Acid Dissociation Constant (pKa)

7.96

Base Dissociation Constant (pKb)

0.28

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.33

References: we are preparing a list of scientific research reports with SB18-0930 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB18-0930?
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What is the minimum amount of SB18-0930 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB18-0930
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB18-0930
  • 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 SB18-0930 available by request