CTK8H6701
TL;DR: CTK8H6701 (CAS 223570-85-2) is a chemical compound with molecular formula C18H21N3O3 and molecular weight 327.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxylate
Also Known As: 8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-YL 2,3-DIHYDROPYRAZOLO[1,5,4-DE][1,4]BENZOXAZINE-6-CARBOXYLATE, 8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-YL2,3-DIHYDROPYRAZOLO[1,5,4-DE][1,4]BENZOXAZINE-6-CARBOXYLATE
| Molecular Formula | C18H21N3O3 |
|---|---|
| Molecular Weight | 327.16 g/mol |
| LogP | 2.2107 |
| Topological Polar Surface Area | 56.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.1583 |
| Heavy Atoms | 24 |
| Complexity | 801.1871 |
Chemical Identifiers
| CAS Number | 223570-85-2 |
|---|---|
| SMILES | CN1C2CCC1CC(C2)OC(=O)C3=NN4CCOC5=CC=CC3=C54 |
Product Overview
CTK8H6701 (CAS 223570-85-2), with molecular formula C18H21N3O3 and molecular weight 327.16 g/mol. IUPAC: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxylate.
Chemical Property Profile of CTK8H6701
Property Insights of CTK8H6701
The XLogP value of 2.2107 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK8H6701. With a topological polar surface area (TPSA) of 56.59 Ų, CTK8H6701 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK8H6701 has 0 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 CTK8H6701?
The CAS number of CTK8H6701 is 223570-85-2.
What is the molecular formula of CTK8H6701?
The molecular formula of CTK8H6701 is C18H21N3O3.
What is the molecular weight of CTK8H6701?
The molecular weight of CTK8H6701 is 327.16 g/mol.
Where can I buy CTK8H6701?
You can request a quote for CTK8H6701 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8H6701?
Yes, KEHONG BIO provides custom synthesis services for CTK8H6701 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.