VU0079574-2
TL;DR: VU0079574-2 (CAS 422273-45-8) is a chemical compound with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyethyl)-4-oxo-N-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide
Also Known As: VU0079574-2, F3168-1618, 3-(2-methoxyethyl)-4-oxo-N-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide, 3-(2-methoxyethyl)-4-oxo-N-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide, N-allyl-3-(2-methoxyethyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
| Molecular Formula | C15H17N3O3S |
|---|---|
| Molecular Weight | 319.10 g/mol |
| LogP | 1.62129 |
| Topological Polar Surface Area | 76.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.09906 |
| Heavy Atoms | 22 |
| Complexity | 822.873 |
Chemical Identifiers
| CAS Number | 422273-45-8 |
|---|---|
| SMILES | COCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC=C)NC1=S |
Product Overview
VU0079574-2 (CAS 422273-45-8), with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol. IUPAC: 3-(2-methoxyethyl)-4-oxo-N-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide.
Chemical Property Profile of VU0079574-2
Property Insights of VU0079574-2
The XLogP value of 1.62129 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0079574-2. The TPSA of 76.12 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0079574-2. Following Lipinski's Rule of Five, VU0079574-2 has 2 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 VU0079574-2?
The CAS number of VU0079574-2 is 422273-45-8.
What is the molecular formula of VU0079574-2?
The molecular formula of VU0079574-2 is C15H17N3O3S.
What is the molecular weight of VU0079574-2?
The molecular weight of VU0079574-2 is 319.10 g/mol.
Where can I buy VU0079574-2?
You can request a quote for VU0079574-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0079574-2?
Yes, KEHONG BIO provides custom synthesis services for VU0079574-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.