1613513-14-6
1613513-14-6 structure
- Name: Autotaxin inhibitor 12
- Chemical Name: 3,5-Dichlorobenzyl 4-{[4-(1H-1,2,3-triazol-4-yl)butanoyl]amino}-1-piperidinecarboxylate
- CAS Number: 1613513-14-6
- Molecular Formula: C19H23Cl2N5O3
- Molecular Weight: 440.324
- Create Date: 2020-01-12 11:38:51
- Modify Date: 2024-01-16 22:42:07
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Autotaxin inhibitor 12 is a highly potent, selective, orally-bioavailable inhibitor of autotaxin with IC50 of 3.1 nM in choline release assays; shows ATX inhibition of IC50 9 nM in an in vitro serum assay, measuring 18:1 LPA levels by LCMS; concentration-dependently inhibits autotaxin and formation of LPA in vivo.
| Name | 3,5-Dichlorobenzyl 4-{[4-(1H-1,2,3-triazol-4-yl)butanoyl]amino}-1-piperidinecarboxylate |
|---|---|
| Synonyms |
1-Piperidinecarboxylic acid, 4-[[1-oxo-4-(1H-1,2,3-triazol-4-yl)butyl]amino]-, (3,5-dichlorophenyl)methyl ester
3,5-Dichlorobenzyl 4-{[4-(1H-1,2,3-triazol-4-yl)butanoyl]amino}-1-piperidinecarboxylate |
| Description | Autotaxin inhibitor 12 is a highly potent, selective, orally-bioavailable inhibitor of autotaxin with IC50 of 3.1 nM in choline release assays; shows ATX inhibition of IC50 9 nM in an in vitro serum assay, measuring 18:1 LPA levels by LCMS; concentration-dependently inhibits autotaxin and formation of LPA in vivo. |
|---|---|
| References | References 1. Thomson CG, et al. Bioorg Med Chem Lett. 2018 May 21. pii: S0960-894X(18)30431-1. View Related Products by Target Autotaxin |
| Density | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 689.2±55.0 °C at 760 mmHg |
| Molecular Formula | C19H23Cl2N5O3 |
| Molecular Weight | 440.324 |
| Flash Point | 370.6±31.5 °C |
| Exact Mass | 439.117798 |
| LogP | 2.73 |
| Vapour Pressure | 0.0±2.2 mmHg at 25°C |
| Index of Refraction | 1.614 |