SB23-0757 Screening compound: (3aR,7aS)-N-isopropyl-5-(2-methoxyacetyl)-7a-(3-methyl-1H-1,2,4-triazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide

SB23-0757 Screening compound: (3aR,7aS)-N-isopropyl-5-(2-methoxyacetyl)-7a-(3-methyl-1H-1,2,4-triazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide
SB23-0757 Screening compound: (3aR,7aS)-N-isopropyl-5-(2-methoxyacetyl)-7a-(3-methyl-1H-1,2,4-triazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB23-0757
(3aR,7aS)-N-isopropyl-5-(2-methoxyacetyl)-7a-(3-methyl-1H-1,2,4-triazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridine-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

SB23-0757

Molecular Formula

C17H28N6O3 (C17 H28 N6 O3)

Compound Name

(3aR,7aS)-N-isopropyl-5-(2-methoxyacetyl)-7a-(3-methyl-1H-1,2,4-triazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridine-2-carboxamide

IUPAC name

(3aR7aS)-5-(2-methoxyacetyl)-7a-(3-methyl-1H-124-triazol-5-yl)-N-(propan-2-yl)-octahydro-1H-pyrrolo[34-c]pyridine-2-carboxamide

SMILES

CC(C)NC(N(C[C@H]1CN(CC2)C(COC)=O)C[C@]12c1nc(C)n[nH]1)=O

InChI

InChI=1S/C17H28N6O3/c1-11(2)18-16(25)23-8-13-7-22(14(24)9-26-4)6-5-17(13,10-23)15-19-12(3)20-21-15/h11,13H,5-10H2,1-4H3,(H,18,25)(H,19,20,21)/t13-,17+/m0/s1

InChI Key

GRMFXKCHZBKJED-SUMWQHHRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.079

Distribution Coefficient, logD

-0.080

Water Solubility, LogSw

-0.96

Polar Surface Area

84.384

Acid Dissociation Constant (pKa)

10.52

Base Dissociation Constant (pKb)

3.51

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

76.47

References: we are preparing a list of scientific research reports with SB23-0757 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB23-0757?
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What is the minimum amount of SB23-0757 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB23-0757
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB23-0757
  • 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 SB23-0757 available by request