VU0508301-1
TL;DR: VU0508301-1 (CAS 858745-39-8) is a chemical compound with molecular formula C16H16N4O4 and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 7-(2-hydroxyethyl)-6-imino-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Also Known As: VU0508301-1, F3067-0035, methyl 1-(2-hydroxyethyl)-2-imino-10-methyl-5-oxo-1,6-dihydropyridino[2,3-d]py ridino[1,2-a]pyrimidine-3-carboxylate, methyl 1-(2-hydroxyethyl)-2-imino-10-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate, methyl 7-(2-hydroxyethyl)-6-imino-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
| Molecular Formula | C16H16N4O4 |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 0.21599 |
| Topological Polar Surface Area | 109.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.11716 |
| Heavy Atoms | 24 |
| Complexity | 1081.2958 |
Chemical Identifiers
| CAS Number | 858745-39-8 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=N)N3CCO)C(=O)OC |
Product Overview
VU0508301-1 (CAS 858745-39-8), with molecular formula C16H16N4O4 and molecular weight 328.12 g/mol. IUPAC: methyl 7-(2-hydroxyethyl)-6-imino-11-methyl-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 VU0508301-1
Property Insights of VU0508301-1
The XLogP value of 0.21599 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0508301-1. The TPSA of 109.68 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0508301-1. Following Lipinski's Rule of Five, VU0508301-1 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 VU0508301-1?
The CAS number of VU0508301-1 is 858745-39-8.
What is the molecular formula of VU0508301-1?
The molecular formula of VU0508301-1 is C16H16N4O4.
What is the molecular weight of VU0508301-1?
The molecular weight of VU0508301-1 is 328.12 g/mol.
Where can I buy VU0508301-1?
You can request a quote for VU0508301-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0508301-1?
Yes, KEHONG BIO provides custom synthesis services for VU0508301-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.