(1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
TL;DR: (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate (CAS 1212144-14-3) is a chemical compound with molecular formula C34H35NO6 and molecular weight 553.24646 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate
Also Known As: (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate, (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate, 3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexanecarboxylate
Technical Specifications
| Molecular Formula | C34H35NO6 |
| Molecular Weight | 553.24646 g/mol |
| XLogP | 6.5 |
| Topological Polar Surface Area (TPSA) | 90.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 553.24646 Da |
| Heavy Atoms | 41 |
| Complexity | 941.0 |
| SMILES | CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)C4CCC(CC4)CNC(=O)OCC5=CC=CC=C5 |
| InChIKey | SNIHOTHAAZELSS-UHFFFAOYSA-N |
Chemical Property Profile of (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
Property Insights of (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
The XLogP value of 6.5 indicates that (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate. Following Lipinski's Rule of Five, (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate?
The CAS number of (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate is 1212144-14-3.
What is the molecular formula of (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate?
The molecular formula of (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate is C34H35NO6.
What is the molecular weight of (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate?
The molecular weight of (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate is 553.24646 g/mol.
Where can I buy (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate?
You can request a quote for (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate?
Yes, CoreyChem provides custom synthesis services for (1r,4r)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.