7N-490S
TL;DR: 7N-490S (CAS 339019-36-2) is a chemical compound with molecular formula C22H21ClN2O2S and molecular weight 412.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenoxy)-5,6,7,8-tetrahydroquinazoline
Also Known As: 7N-490S, 2-[(2-chlorobenzyl)sulfanyl]-5,6,7,8-tetrahydro-4-quinazolinyl 4-methoxyphenyl ether, 2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenoxy)-5,6,7,8-tetrahydroquinazoline, 2-{[(2-chlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenoxy)-5,6,7,8-tetrahydroquinazoline
| Molecular Formula | C22H21ClN2O2S |
|---|---|
| Molecular Weight | 412.10 g/mol |
| LogP | 6.102 |
| Topological Polar Surface Area | 44.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.10123 |
| Heavy Atoms | 28 |
| Complexity | 963.2506 |
Chemical Identifiers
| CAS Number | 339019-36-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OC2=NC(=NC3=C2CCCC3)SCC4=CC=CC=C4Cl |
Product Overview
7N-490S (CAS 339019-36-2), with molecular formula C22H21ClN2O2S and molecular weight 412.10 g/mol. IUPAC: 2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenoxy)-5,6,7,8-tetrahydroquinazoline.
Chemical Property Profile of 7N-490S
Property Insights of 7N-490S
The XLogP value of 6.102 indicates that 7N-490S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.24 Ų, 7N-490S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7N-490S 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-490S?
The CAS number of 7N-490S is 339019-36-2.
What is the molecular formula of 7N-490S?
The molecular formula of 7N-490S is C22H21ClN2O2S.
What is the molecular weight of 7N-490S?
The molecular weight of 7N-490S is 412.10 g/mol.
Where can I buy 7N-490S?
You can request a quote for 7N-490S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7N-490S?
Yes, KEHONG BIO provides custom synthesis services for 7N-490S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.