1217790-09-4 | (1R,2R,3R,4S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]bicyclo[2.2.1]heptane-2-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
1mg		2 weeks	$105.00	$73.00
2mg		2 weeks	$123.00	$86.00
3mg		2 weeks	$149.00	$105.00
5mg		2 weeks	$168.00	$118.00
10mg		2 weeks	$193.00	$135.00

Description

• Catalog Number: AV18426
• Chemical Name: (1R,2R,3R,4S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]bicyclo[2.2.1]heptane-2-carboxylic acid
• CAS Number: 1217790-09-4
• Molecular Formula: C13H21NO4
• Molecular Weight: 255.3101
• MDL Number: MFCD31579939
• SMILES: O=C(OC(C)(C)C)N[C@@H]1[C@H]2CC[C@@H]([C@H]1C(=O)O)C2

Computed Properties

• Complexity: 361
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 4
• Heavy Atom Count: 18
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 4
• XLogP3: 2.4

Upstream Synthesis Route

The rel-(1R,2R,3R,4S)-3-((tert-Butoxycarbonyl)amino)bicyclo[2.2.1]heptane-2-carboxylic acid serves as a versatile building block in chemical synthesis. Its unique structure allows for the introduction of functional groups at specific positions, enabling the formation of intricate molecular structures. This compound is particularly valuable in the synthesis of constrained cyclic peptides and other bioactive molecules where the rigid bicyclic framework can help enhance biological activity and specificity. Additionally, the presence of the tert-butoxycarbonyl protecting group ensures selective reactivity, making it a valuable tool for the controlled manipulation of the molecule in multi-step synthetic routes.