1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-
TL;DR: 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- (CAS 88718-33-6) is a chemical compound with molecular formula C14H24N4 and molecular weight 248.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6,9,13-tetrazabicyclo[12.4.0]octadeca-1(18),14,16-triene
Also Known As: Benzocyclam, J1.864.328F, 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-1,5,8,12-benzotetraazacyclotetradecine, 2,6,9,13-tetrazabicyclo[12.4.0]octadeca-1(18),14,16-triene
| Molecular Formula | C14H24N4 |
|---|---|
| Molecular Weight | 248.20 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 48.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.2001 |
| Heavy Atoms | 18 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 88718-33-6 |
|---|---|
| SMILES | C1CNCCNCCCNC2=CC=CC=C2NC1 |
| InChIKey | VOGOAVNFGZVUQT-UHFFFAOYSA-N |
Product Overview
1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- (CAS 88718-33-6), with molecular formula C14H24N4 and molecular weight 248.20 g/mol. IUPAC: 2,6,9,13-tetrazabicyclo[12.4.0]octadeca-1(18),14,16-triene.
Chemical Property Profile of 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-
Property Insights of 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-. With a topological polar surface area (TPSA) of 48.1 Ų, 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- has 4 hydrogen bond donor(s) and 4 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 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-?
The CAS number of 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- is 88718-33-6.
What is the molecular formula of 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-?
The molecular formula of 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- is C14H24N4.
What is the molecular weight of 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-?
The molecular weight of 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- is 248.20 g/mol.
Where can I buy 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-?
You can request a quote for 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-?
Yes, KEHONG BIO provides custom synthesis services for 1,5,8,12-Benzotetraazacyclotetradecine, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.