6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine
TL;DR: 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine (CAS 109888-86-0) is a chemical compound with molecular formula C21H29N3O2 and molecular weight 355.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,8-dioxa-5,15,21-triazatricyclo[20.4.0.09,14]hexacosa-1(26),9,11,13,22,24-hexaene
Also Known As: 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine, 6H,16H-Dibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine, 7,8,9,10,17,18,19,20,21,22-decahydro-, 7,8,9,10,17,18,19,20,21,22-decahydro-6H,16H-dibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine
| Molecular Formula | C21H29N3O2 |
|---|---|
| Molecular Weight | 355.23 g/mol |
| LogP | 3.7417 |
| Topological Polar Surface Area | 54.55 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 355.22598 |
| Heavy Atoms | 26 |
| Complexity | 551.70935 |
Chemical Identifiers
| CAS Number | 109888-86-0 |
|---|---|
| SMILES | C1CCNC2=CC=CC=C2OCCNCCOC3=CC=CC=C3NCC1 |
Product Overview
6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine (CAS 109888-86-0), with molecular formula C21H29N3O2 and molecular weight 355.23 g/mol. IUPAC: 2,8-dioxa-5,15,21-triazatricyclo[20.4.0.09,14]hexacosa-1(26),9,11,13,22,24-hexaene.
Chemical Property Profile of 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine
Property Insights of 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine
The XLogP value of 3.7417 indicates that 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.55 Ų, 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine has 3 hydrogen bond donor(s) and 5 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 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine?
The CAS number of 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine is 109888-86-0.
What is the molecular formula of 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine?
The molecular formula of 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine is C21H29N3O2.
What is the molecular weight of 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine?
The molecular weight of 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine is 355.23 g/mol.
Where can I buy 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine?
You can request a quote for 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine?
Yes, KEHONG BIO provides custom synthesis services for 6,7,8,9,10,16,17,18,19,20,21,22-dodecahydrodibenzo[h,q][1,7,4,10,16]dioxatriazacyclooctadecine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.