VU0105636-2
TL;DR: VU0105636-2 (CAS 362501-01-7) is a chemical compound with molecular formula C21H22ClN3O3S and molecular weight 431.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methoxyphenyl)-4-oxo-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxamide
Also Known As: VU0105636-2, F3168-0112, N-(3-chloro-4-methoxyphenyl)-4-oxo-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxamide, N-(3-chloro-4-methoxyphenyl)-4-oxo-3-pentyl-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide, N-(3-chloro-4-methoxyphenyl)-4-oxo-3-pentyl-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
| Molecular Formula | C21H22ClN3O3S |
|---|---|
| Molecular Weight | 431.11 g/mol |
| LogP | 5.16359 |
| Topological Polar Surface Area | 76.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.10703 |
| Heavy Atoms | 29 |
| Complexity | 1170.0255 |
Chemical Identifiers
| CAS Number | 362501-01-7 |
|---|---|
| SMILES | CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)Cl)NC1=S |
Product Overview
VU0105636-2 (CAS 362501-01-7), with molecular formula C21H22ClN3O3S and molecular weight 431.11 g/mol. IUPAC: N-(3-chloro-4-methoxyphenyl)-4-oxo-3-pentyl-2-sulfanylidene-1H-quinazoline-7-carboxamide.
Chemical Property Profile of VU0105636-2
Property Insights of VU0105636-2
The XLogP value of 5.16359 indicates that VU0105636-2 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 VU0105636-2. Following Lipinski's Rule of Five, VU0105636-2 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of VU0105636-2?
The CAS number of VU0105636-2 is 362501-01-7.
What is the molecular formula of VU0105636-2?
The molecular formula of VU0105636-2 is C21H22ClN3O3S.
What is the molecular weight of VU0105636-2?
The molecular weight of VU0105636-2 is 431.11 g/mol.
Where can I buy VU0105636-2?
You can request a quote for VU0105636-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0105636-2?
Yes, KEHONG BIO provides custom synthesis services for VU0105636-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.