SA21-1092 Screening compound: 1-(2,6-dimethoxypyridine-3-carbonyl)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpyrrolidin-3-amine

SA21-1092 Screening compound: 1-(2,6-dimethoxypyridine-3-carbonyl)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpyrrolidin-3-amine
SA21-1092 Screening compound: 1-(2,6-dimethoxypyridine-3-carbonyl)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpyrrolidin-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA21-1092
1-(2,6-dimethoxypyridine-3-carbonyl)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpyrrolidin-3-amine

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

SA21-1092

Molecular Formula

C18H27N7O4 (C18 H27 N7 O4)

Compound Name

1-(2,6-dimethoxypyridine-3-carbonyl)-3-[1-(2-methoxyethyl)-1H-1,2,3,4-tetrazol-5-yl]-N,N-dimethylpyrrolidin-3-amine

IUPAC name

1-(26-dimethoxypyridine-3-carbonyl)-3-[1-(2-methoxyethyl)-1H-1234-tetrazol-5-yl]-NN-dimethylpyrrolidin-3-amine

SMILES

CN(C)C(CC1)(CN1C(c(ccc(OC)n1)c1OC)=O)c1nnnn1CCOC

InChI

InChI=1S/C18H27N7O4/c1-23(2)18(17-20-21-22-25(17)10-11-27-3)8-9-24(12-18)16(26)13-6-7-14(28-4)19-15(13)29-5/h6-7H,8-12H2,1-5H3/t18-/m0/s1

InChI Key

QKVIWMQHEAUNOU-SFHVURJKSA-N

MDL Number (MFCD)

MFCD32235098

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.46

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.934

Distribution Coefficient, logD

0.934

Water Solubility, LogSw

-2.27

Polar Surface Area

91.501

Acid Dissociation Constant (pKa)

23.19

Base Dissociation Constant (pKb)

4.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.11

SA21-1092 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA21-1092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA21-1092?
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What is the minimum amount of SA21-1092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA21-1092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA21-1092
  • 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 SA21-1092 available by request