![methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate structure](/static/products/851/851745-24-9.png)
methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate
TL;DR: methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate (CAS 851745-24-9) is a chemical compound with molecular formula C22H23N3O3 and molecular weight 377.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 9,9-dimethyl-7-oxo-6-pyridin-3-yl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepine-2-carboxylate
Also Known As: methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate, methyl 9,9-dimethyl-7-oxo-6-pyridin-3-yl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepine-2-carboxylate, methyl 14,14-dimethyl-12-oxo-10-(pyrid-3-yl)-2,9-diazatricyclo[9.4.0.0^(3,8)], methyl 14,14-dimethyl-12-oxo-10-(pyridin-3-yl)-2,9-diazatricyclo[9.4.0.0(3),?]pentadeca-1(11),3,5,7-tetraene-5-carboxylate, methyl 14,14-dimethyl-12-oxo-10-(pyridin-3-yl)-2,9-diazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7-tetraene-5-carboxylate
| Molecular Formula | C22H23N3O3 |
|---|---|
| Molecular Weight | 377.17 g/mol |
| LogP | 4.0901 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.17395 |
| Heavy Atoms | 28 |
| Complexity | 979.7764 |
Chemical Identifiers
| CAS Number | 851745-24-9 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)OC)C4=CN=CC=C4)C(=O)C1)C |
Product Overview
methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate (CAS 851745-24-9), with molecular formula C22H23N3O3 and molecular weight 377.17 g/mol. IUPAC: methyl 9,9-dimethyl-7-oxo-6-pyridin-3-yl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepine-2-carboxylate.
Chemical Property Profile of methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate
Property Insights of methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate
The XLogP value of 4.0901 indicates that methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate. Following Lipinski's Rule of Five, methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate has 2 hydrogen bond donor(s) and 6 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 methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate?
The CAS number of methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate is 851745-24-9.
What is the molecular formula of methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate?
The molecular formula of methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate is C22H23N3O3.
What is the molecular weight of methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate?
The molecular weight of methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate is 377.17 g/mol.
Where can I buy methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate?
You can request a quote for methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2,9-diaza-14,14-dimethyl-12-oxo-10-(3-pyridyl)tricyclo[9.4.0.0<3,8>]pentadeca-1(11),3(4),5,7-tetraene-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.