Account Methyl 4-(2-chloro-4-fluorophenyl)-6-(((1-(2-(2-(2-(3-(3-methyl-3H-diazirin-3-yl)propanamido)ethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)methyl)-2-(pyridin-4-yl)-1,4-dihydropyrimidine-5-carboxylate
- Catalog No. :
- ACQERU687
- CAS No. :
- 2346634-03-3
- Molecular Formula :
- C32H37ClFN9O6
- Molecular Weight :
- 698.16
IUPAC Name:methyl 4-(2-chloro-4-fluorophenyl)-6-(((1-(2-(2-(2-(3-(3-methyl-3H-diazirin-3-yl)propanamido)ethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)methyl)-2-(pyridin-4-yl)-1,4-dihydropyrimidine-5-carboxylate
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Product Information
| Product Name | Methyl 4-(2-chloro-4-fluorophenyl)-6-(((1-(2-(2-(2-(3-(3-methyl-3H-diazirin-3-yl)propanamido)ethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)methyl)-2-(pyridin-4-yl)-1,4-dihydropyrimidine-5-carboxylate |
|---|---|
| IUPAC Name | methyl 4-(2-chloro-4-fluorophenyl)-6-(((1-(2-(2-(2-(3-(3-methyl-3H-diazirin-3-yl)propanamido)ethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)methyl)-2-(pyridin-4-yl)-1,4-dihydropyrimidine-5-carboxylate |
| Molecular Formula | C32H37ClFN9O6 |
| Molecular Weight | 698.16 |
| SMILES | O=C(C1=C(COCC2=CN(CCOCCOCCNC(CCC3(C)N=N3)=O)N=N2)NC(C4=CC=NC=C4)=NC1C5=CC=C(F)C=C5Cl)OC |
| InChI Key | JXHOSRXIWYSIDU-UHFFFAOYSA-N |
| Synonym | 5-Pyrimidinecarboxylic acid, 4-(2-chloro-4-fluorophenyl)-1,4-dihydro-6-[[[1-[2-[2-[2-[[3-(3-methyl-3H-diazirin-3-yl)-1-oxopropyl]amino]ethoxy]ethoxy]ethyl]-1H-1,2,3-triazol-4-yl]methoxy]methyl]-2-(4-pyridinyl)-, methyl ester |
| CAS No. | 2346634-03-3 |
Safety Data
- Pictogram
- Signal Word
- Gefahr
- Hazard Statement(s)
- H228-H315-H319
- Precautionary Statement(s)
- P210-P240-P241-P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P370+P378
Synthetic Route by SureRoute
2. ACQERU687 Molecular Building Block Synthetic Route
Methyl 4-(2-chloro-4-fluorophenyl)-6-(((1-(2-(2-(2-hydroxyethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)methyl)-2-(pyridin-4-yl)-1,4-dihydropyrimidine-5-carboxylate
Methyl 6-(((1-(2-(2-(2-(4-azidobenzamido)ethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)methyl)-4-(2-chloro-4-fluorophenyl)-2-(pyridin-4-yl)-1,4-dihydropyrimidine-5-carboxylate
Methyl 6-(((1-(2-(2-(2-(3-azido-5-(azidomethyl)benzamido)ethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)methyl)-4-(2-chloro-4-fluorophenyl)-2-(pyridin-4-yl)-1,4-dihydropyrimidine-5-carboxylate