VU0288806-3
TL;DR: VU0288806-3 (CAS 496796-87-3) is a chemical compound with molecular formula C16H16N4O3 and molecular weight 312.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-imino-7,11-dimethyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Also Known As: VU0288806-3, F3067-0169, ethyl 2-imino-1,10-dimethyl-5-oxo-1,6-dihydropyridino[2,3-d]pyridino[1,2-a]pyr imidine-3-carboxylate, ethyl 2-imino-1,10-dimethyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate, ethyl 6-imino-7,11-dimethyl-2-oxo-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
| Molecular Formula | C16H16N4O3 |
|---|---|
| Molecular Weight | 312.12 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 86.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.12225 |
| Heavy Atoms | 23 |
| Complexity | 783.0 |
Chemical Identifiers
| CAS Number | 496796-87-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N=C3C(=CC=CN3C2=O)C)N(C1=N)C |
| InChIKey | HQPUPJORNOUACY-UHFFFAOYSA-N |
Product Overview
VU0288806-3 (CAS 496796-87-3), with molecular formula C16H16N4O3 and molecular weight 312.12 g/mol. IUPAC: ethyl 6-imino-7,11-dimethyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate.
Chemical Property Profile of VU0288806-3
Property Insights of VU0288806-3
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0288806-3. The TPSA of 86.1 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0288806-3. Following Lipinski's Rule of Five, VU0288806-3 has 1 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 VU0288806-3?
The CAS number of VU0288806-3 is 496796-87-3.
What is the molecular formula of VU0288806-3?
The molecular formula of VU0288806-3 is C16H16N4O3.
What is the molecular weight of VU0288806-3?
The molecular weight of VU0288806-3 is 312.12 g/mol.
Where can I buy VU0288806-3?
You can request a quote for VU0288806-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0288806-3?
Yes, KEHONG BIO provides custom synthesis services for VU0288806-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.