VU0508300-1
TL;DR: VU0508300-1 (CAS 29494-77-7) is a chemical compound with molecular formula C13H9N5O and molecular weight 251.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-imino-7-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
Also Known As: VU0508300-1, 2-imino-1-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile, F3067-0034, 6-imino-7-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile, 2-imino-1-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
| Molecular Formula | C13H9N5O |
|---|---|
| Molecular Weight | 251.08 g/mol |
| LogP | 0.53735 |
| Topological Polar Surface Area | 86.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.0807 |
| Heavy Atoms | 19 |
| Complexity | 974.3778 |
Chemical Identifiers
| CAS Number | 29494-77-7 |
|---|---|
| SMILES | CN1C2=C(C=C(C1=N)C#N)C(=O)N3C=CC=CC3=N2 |
Product Overview
VU0508300-1 (CAS 29494-77-7), with molecular formula C13H9N5O and molecular weight 251.08 g/mol. IUPAC: 6-imino-7-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile.
Chemical Property Profile of VU0508300-1
Property Insights of VU0508300-1
The XLogP value of 0.53735 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0508300-1. The TPSA of 86.94 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0508300-1. Following Lipinski's Rule of Five, VU0508300-1 has 1 hydrogen bond donor(s) and 4 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 VU0508300-1?
The CAS number of VU0508300-1 is 29494-77-7.
What is the molecular formula of VU0508300-1?
The molecular formula of VU0508300-1 is C13H9N5O.
What is the molecular weight of VU0508300-1?
The molecular weight of VU0508300-1 is 251.08 g/mol.
Where can I buy VU0508300-1?
You can request a quote for VU0508300-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0508300-1?
Yes, KEHONG BIO provides custom synthesis services for VU0508300-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.