7N-499S
TL;DR: 7N-499S (CAS 339019-42-0) is a chemical compound with molecular formula C23H24N2O2S2 and molecular weight 424.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methylphenyl)methylsulfonyl]-4-(4-methylphenyl)sulfanyl-5,6,7,8-tetrahydroquinazoline
Also Known As: 7N-499S, 4-methylbenzyl 4-[(4-methylphenyl)sulfanyl]-5,6,7,8-tetrahydro-2-quinazolinyl sulfone, 2-[(4-methylphenyl)methanesulfonyl]-4-[(4-methylphenyl)sulfanyl]-5,6,7,8-tetrahydroquinazoline, 2-[(4-methylphenyl)methylsulfonyl]-4-(4-methylphenyl)sulfanyl-5,6,7,8-tetrahydroquinazoline
| Molecular Formula | C23H24N2O2S2 |
|---|---|
| Molecular Weight | 424.13 g/mol |
| LogP | 5.09734 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.12793 |
| Heavy Atoms | 29 |
| Complexity | 1122.7894 |
Chemical Identifiers
| CAS Number | 339019-42-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CS(=O)(=O)C2=NC3=C(CCCC3)C(=N2)SC4=CC=C(C=C4)C |
Product Overview
7N-499S (CAS 339019-42-0), with molecular formula C23H24N2O2S2 and molecular weight 424.13 g/mol. IUPAC: 2-[(4-methylphenyl)methylsulfonyl]-4-(4-methylphenyl)sulfanyl-5,6,7,8-tetrahydroquinazoline.
Chemical Property Profile of 7N-499S
Property Insights of 7N-499S
The XLogP value of 5.09734 indicates that 7N-499S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.92 Ų, 7N-499S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7N-499S has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7N-499S?
The CAS number of 7N-499S is 339019-42-0.
What is the molecular formula of 7N-499S?
The molecular formula of 7N-499S is C23H24N2O2S2.
What is the molecular weight of 7N-499S?
The molecular weight of 7N-499S is 424.13 g/mol.
Where can I buy 7N-499S?
You can request a quote for 7N-499S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7N-499S?
Yes, KEHONG BIO provides custom synthesis services for 7N-499S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.