![Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. structure](/static/products/4052/40521-08-2.webp)
Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.
TL;DR: Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. (CAS 40521-08-2) is a chemical compound with molecular formula C21H27NO7 and molecular weight 405.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxo-4-pyridinyl] adamantane-1-carboxylate
Also Known As: Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der., [1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyridin-4-yl] adamantane-1-carboxylate, 1-Pentofuranosyl-4-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)oxy]pyridin-2(1H)-one, Tricyclo[3.3.1.13, 1,2-dihydro-2-oxo-1-.beta.-D-ribofuranosyl-4-pyridinyl ester, [1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-4-pyridyl] adamantane-1-carboxylate
| Molecular Formula | C21H27NO7 |
|---|---|
| Molecular Weight | 405.18 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.17874 |
| Heavy Atoms | 29 |
| Complexity | 734.0 |
Chemical Identifiers
| CAS Number | 40521-08-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)OC4=CC(=O)N(C=C4)C5C(C(C(O5)CO)O)O |
| InChIKey | BFMYZJUICQKXGG-UHFFFAOYSA-N |
Product Overview
Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. (CAS 40521-08-2), with molecular formula C21H27NO7 and molecular weight 405.18 g/mol. IUPAC: [1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxo-4-pyridinyl] adamantane-1-carboxylate.
Chemical Property Profile of Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.
Property Insights of Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.. Following Lipinski's Rule of Five, Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.?
The CAS number of Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. is 40521-08-2.
What is the molecular formula of Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.?
The molecular formula of Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. is C21H27NO7.
What is the molecular weight of Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.?
The molecular weight of Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. is 405.18 g/mol.
Where can I buy Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.?
You can request a quote for Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der.?
Yes, KEHONG BIO provides custom synthesis services for Tricyclo[3.3.1.13,7]decane-1-carboxylic acid der. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.