![2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile structure](/static/products/176/176701-82-9.png)
2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile
TL;DR: 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile (CAS 176701-82-9) is a chemical compound with molecular formula C15H17N3O and molecular weight 255.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5,11,13-tetramethyl-4-oxa-1,10-diazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraene-8-carbonitrile
Also Known As: 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile
| Molecular Formula | C15H17N3O |
|---|---|
| Molecular Weight | 255.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 50.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 255.13716 |
| Heavy Atoms | 19 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 176701-82-9 |
|---|---|
| SMILES | CC1=CC(=NC2=C(C3=C(N12)COC(C3)(C)C)C#N)C |
| InChIKey | ZTHCFLNBWBCBQX-UHFFFAOYSA-N |
Product Overview
2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile (CAS 176701-82-9), with molecular formula C15H17N3O and molecular weight 255.14 g/mol. IUPAC: 5,5,11,13-tetramethyl-4-oxa-1,10-diazatricyclo[7.4.0.02,7]trideca-2(7),8,10,12-tetraene-8-carbonitrile.
Chemical Property Profile of 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile
Property Insights of 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile. With a topological polar surface area (TPSA) of 50.3 Ų, 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile has 0 hydrogen bond donor(s) and 3 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 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile?
The CAS number of 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile is 176701-82-9.
What is the molecular formula of 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile?
The molecular formula of 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile is C15H17N3O.
What is the molecular weight of 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile?
The molecular weight of 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile is 255.14 g/mol.
Where can I buy 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile?
You can request a quote for 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,4,8,8-tetramethyl-5,8,9-trihydro-6H-pyrano[3,4-b]pyrimidino[1,2-d]pyrrole-10 -carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.