3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide
TL;DR: 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide (CAS 7053-35-2) is a chemical compound with molecular formula C27H32N2O3 and molecular weight 432.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[1,7,7-trimethyl-4-[(4-propan-2-ylphenyl)carbamoyl]-2-bicyclo[2.2.1]heptanylidene]amino] benzoate
Also Known As: 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide, [[1,7,7-trimethyl-4-[(4-propan-2-ylphenyl)carbamoyl]-2-bicyclo[2.2.1]heptanylidene]amino] benzoate, [[4,7,7-trimethyl-1-[(4-propan-2-ylphenyl)carbamoyl]-3-bicyclo[2.2.1]heptylidene]amino] Benzoate
| Molecular Formula | C27H32N2O3 |
|---|---|
| Molecular Weight | 432.24 g/mol |
| LogP | 6.1779 |
| Topological Polar Surface Area | 67.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.2413 |
| Heavy Atoms | 32 |
| Complexity | 1056.0688 |
Chemical Identifiers
| CAS Number | 7053-35-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NC(=O)C23CCC(C2(C)C)(C(=NOC(=O)C4=CC=CC=C4)C3)C |
Product Overview
3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide (CAS 7053-35-2), with molecular formula C27H32N2O3 and molecular weight 432.24 g/mol. IUPAC: [[1,7,7-trimethyl-4-[(4-propan-2-ylphenyl)carbamoyl]-2-bicyclo[2.2.1]heptanylidene]amino] benzoate.
Chemical Property Profile of 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide
Property Insights of 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide
The XLogP value of 6.1779 indicates that 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide. Following Lipinski's Rule of Five, 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide 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 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide?
The CAS number of 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide is 7053-35-2.
What is the molecular formula of 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide?
The molecular formula of 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide is C27H32N2O3.
What is the molecular weight of 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide?
The molecular weight of 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide is 432.24 g/mol.
Where can I buy 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide?
You can request a quote for 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Benzoyloxy)imino]-4,7,7-trimethyl-N-[4-(propan-2-yl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.