VU0079545-2
TL;DR: VU0079545-2 (CAS 422273-58-3) is a chemical compound with molecular formula C20H25N3O3S and molecular weight 387.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(cyclohexen-1-yl)ethyl]-3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide
Also Known As: VU0079545-2, AB00683385-01, F3168-1629, N-(2-(cyclohex-1-en-1-yl)ethyl)-3-(2-methoxyethyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide, N-[2-(cyclohex-1-en-1-yl)ethyl]-3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
| Molecular Formula | C20H25N3O3S |
|---|---|
| Molecular Weight | 387.16 g/mol |
| LogP | 3.32579 |
| Topological Polar Surface Area | 76.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.16165 |
| Heavy Atoms | 27 |
| Complexity | 974.57623 |
Chemical Identifiers
| CAS Number | 422273-58-3 |
|---|---|
| SMILES | COCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCCC3=CCCCC3)NC1=S |
Product Overview
VU0079545-2 (CAS 422273-58-3), with molecular formula C20H25N3O3S and molecular weight 387.16 g/mol. IUPAC: N-[2-(cyclohexen-1-yl)ethyl]-3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide.
Chemical Property Profile of VU0079545-2
Property Insights of VU0079545-2
The XLogP value of 3.32579 indicates that VU0079545-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.12 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0079545-2. Following Lipinski's Rule of Five, VU0079545-2 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 VU0079545-2?
The CAS number of VU0079545-2 is 422273-58-3.
What is the molecular formula of VU0079545-2?
The molecular formula of VU0079545-2 is C20H25N3O3S.
What is the molecular weight of VU0079545-2?
The molecular weight of VU0079545-2 is 387.16 g/mol.
Where can I buy VU0079545-2?
You can request a quote for VU0079545-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0079545-2?
Yes, KEHONG BIO provides custom synthesis services for VU0079545-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.