Account 2-(((R)-2-((S)-2-((4-Carbamimidoylbenzyl)carbamoyl)azetidin-1-yl)-1-cyclohexyl-2-oxoethyl)amino)acetic acid
- Catalog No. :
- ACPIBG983
- CAS No. :
- 159776-70-2
- Molecular Formula :
- C22H31N5O4
- Molecular Weight :
- 429.52
IUPAC Name:((R)-2-((S)-2-((4-carbamimidoylbenzyl)carbamoyl)azetidin-1-yl)-1-cyclohexyl-2-oxoethyl)glycine
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Product Information
| Product Name | 2-(((R)-2-((S)-2-((4-Carbamimidoylbenzyl)carbamoyl)azetidin-1-yl)-1-cyclohexyl-2-oxoethyl)amino)acetic acid |
|---|---|
| IUPAC Name | ((R)-2-((S)-2-((4-carbamimidoylbenzyl)carbamoyl)azetidin-1-yl)-1-cyclohexyl-2-oxoethyl)glycine |
| Molecular Formula | C22H31N5O4 |
| Molecular Weight | 429.52 |
| SMILES | O=C(O)CN[C@H](C1CCCCC1)C(N2[C@H](C(NCC3=CC=C(C(N)=N)C=C3)=O)CC2)=O |
| InChI Key | DKWNMCUOEDMMIN-PKOBYXMFSA-N |
| Synonym | 159776-70-2 (free base) | Q27084209 | ((R)-2-((S)-2-((4-carbamimidoylbenzyl)carbamoyl)azetidin-1-yl)-1-cyclohexyl-2-oxoethyl)glycine | BBL000591 | N-((R)-(((2S)-2-((p-Amidinobenzyl)carbamoyl)-1-azetidinyl)carbonyl)cyclohexylmethyl)glycine | SMR000272989 | |
| CAS No. | 159776-70-2 |
| PubChem CID | 183797 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACPIBG983 Molecular Building Block Synthetic Route
((R)-1-cyclohexyl-2-((S)-2-((4-(N-hydroxycarbamimidoyl)benzyl)carbamoyl)azetidin-1-yl)-2-oxoethyl)glycine
Ethyl ((R)-1-cyclohexyl-2-((S)-2-((4-(N-hydroxycarbamimidoyl)benzyl)carbamoyl)azetidin-1-yl)-2-oxoethyl)glycinate
Ethyl ((R)-2-((S)-2-((4-cyanobenzyl)carbamoyl)azetidin-1-yl)-1-cyclohexyl-2-oxoethyl)glycinate