![5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one structure](/static/products/2962/29622-53-5.webp)
5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one
TL;DR: 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one (CAS 29622-53-5) is a chemical compound with molecular formula C16H22N2O2S and molecular weight 306.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one
Also Known As: 5-methyl-3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one, 5-methyl-3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-, 5-METHYL-3-[4-(PENTYLOXY)PHENYL]-2-SULFANYLIDENE-1,3-DIAZINAN-4-ONE
| Molecular Formula | C16H22N2O2S |
|---|---|
| Molecular Weight | 306.14 g/mol |
| LogP | 3.1128 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 306.1402 |
| Heavy Atoms | 21 |
| Complexity | 501.50336 |
Chemical Identifiers
| CAS Number | 29622-53-5 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)N2C(=O)C(CNC2=S)C |
Product Overview
5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one (CAS 29622-53-5), with molecular formula C16H22N2O2S and molecular weight 306.14 g/mol. IUPAC: 5-methyl-3-(4-pentoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one.
Chemical Property Profile of 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one
Property Insights of 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one
The XLogP value of 3.1128 indicates that 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one has 1 hydrogen bond donor(s) and 3 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 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one?
The CAS number of 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one is 29622-53-5.
What is the molecular formula of 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one?
The molecular formula of 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one is C16H22N2O2S.
What is the molecular weight of 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one?
The molecular weight of 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one is 306.14 g/mol.
Where can I buy 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one?
You can request a quote for 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-3-[4-(pentyloxy)phenyl]-2-sulfanylidene-1,3-diazinan-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.