(-)-dibornyl benzylaminobenzylphosphonate
TL;DR: (-)-dibornyl benzylaminobenzylphosphonate (CAS 474879-29-3) is a chemical compound with molecular formula C34H48NO3P and molecular weight 549.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-1-[bis[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]phosphoryl]-1-phenylmethanamine
Also Known As: (-)-dibornyl benzylaminobenzylphosphonate, F0794-0080, bis{1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl} [(benzylamino)(phenyl)methyl]phosphonate, bis(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl) [(benzylamino)(phenyl)methyl]phosphonate, (1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl ((1S,2S,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl) ((benzylamino)(phenyl)methyl)phosphonate
| Molecular Formula | C34H48NO3P |
|---|---|
| Molecular Weight | 549.34 g/mol |
| LogP | 9.1309 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 549.33716 |
| Heavy Atoms | 39 |
| Complexity | 1179.5162 |
Chemical Identifiers
| CAS Number | 474879-29-3 |
|---|---|
| SMILES | CC1(C2CCC1(C(C2)OP(=O)(C(C3=CC=CC=C3)NCC4=CC=CC=C4)OC5CC6CCC5(C6(C)C)C)C)C |
Product Overview
(-)-dibornyl benzylaminobenzylphosphonate (CAS 474879-29-3), with molecular formula C34H48NO3P and molecular weight 549.34 g/mol. IUPAC: N-benzyl-1-[bis[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]phosphoryl]-1-phenylmethanamine.
Chemical Property Profile of (-)-dibornyl benzylaminobenzylphosphonate
Property Insights of (-)-dibornyl benzylaminobenzylphosphonate
The XLogP value of 9.1309 indicates that (-)-dibornyl benzylaminobenzylphosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, (-)-dibornyl benzylaminobenzylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (-)-dibornyl benzylaminobenzylphosphonate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (-)-dibornyl benzylaminobenzylphosphonate?
The CAS number of (-)-dibornyl benzylaminobenzylphosphonate is 474879-29-3.
What is the molecular formula of (-)-dibornyl benzylaminobenzylphosphonate?
The molecular formula of (-)-dibornyl benzylaminobenzylphosphonate is C34H48NO3P.
What is the molecular weight of (-)-dibornyl benzylaminobenzylphosphonate?
The molecular weight of (-)-dibornyl benzylaminobenzylphosphonate is 549.34 g/mol.
Where can I buy (-)-dibornyl benzylaminobenzylphosphonate?
You can request a quote for (-)-dibornyl benzylaminobenzylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-dibornyl benzylaminobenzylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for (-)-dibornyl benzylaminobenzylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.