SB20-1269 Screening compound: 1-{[(2S)-1-(3,5-dimethylbenzoyl)tetrahydro-1H-pyrrol-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-carboxamide

SB20-1269 Screening compound: 1-{[(2S)-1-(3,5-dimethylbenzoyl)tetrahydro-1H-pyrrol-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-carboxamide
SB20-1269 Screening compound: 1-{[(2S)-1-(3,5-dimethylbenzoyl)tetrahydro-1H-pyrrol-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB20-1269
1-{[(2S)-1-(3,5-dimethylbenzoyl)tetrahydro-1H-pyrrol-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-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

SB20-1269

Molecular Formula

C20H27N5O3 (C20 H27 N5 O3)

Compound Name

1-{[(2S)-1-(3,5-dimethylbenzoyl)tetrahydro-1H-pyrrol-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-carboxamide

IUPAC name

1-{[(2S)-1-(35-dimethylbenzoyl)pyrrolidin-2-yl]methyl}-N-(2-methoxyethyl)-1H-123-triazole-4-carboxamide

SMILES

Cc1cc(C(N2[C@H](Cn3nnc(C(NCCOC)=O)c3)CCC2)=O)cc(C)c1

InChI

InChI=1S/C20H27N5O3/c1-14-9-15(2)11-16(10-14)20(27)25-7-4-5-17(25)12-24-13-18(22-23-24)19(26)21-6-8-28-3/h9-11,13,17H,4-8,12H2,1-3H3,(H,21,26)/t17-/m0/s1

InChI Key

MHLWIBBPWFWBII-KRWDZBQOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.584

Distribution Coefficient, logD

1.584

Water Solubility, LogSw

-1.90

Polar Surface Area

76.281

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

-2.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with SB20-1269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB20-1269?
Check Price and Availability of SB20-1269, 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 SB20-1269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB20-1269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB20-1269
  • 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 SB20-1269 available by request