10J-321S
TL;DR: 10J-321S (CAS 860609-19-4) is a chemical compound with molecular formula C19H23F3N2OS and molecular weight 384.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-tert-butylphenyl)methylsulfanyl]-3-propyl-6-(trifluoromethyl)pyrimidin-4-one
Also Known As: 10J-321S, 2-{[4-(tert-butyl)benzyl]sulfanyl}-3-propyl-6-(trifluoromethyl)-4(3H)-pyrimidinone, 2-[(4-tert-butylphenyl)methylsulfanyl]-3-propyl-6-(trifluoromethyl)pyrimidin-4-one, 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-propyl-6-(trifluoromethyl)-3,4-dihydropyrimidin-4-one
| Molecular Formula | C19H23F3N2OS |
|---|---|
| Molecular Weight | 384.15 g/mol |
| LogP | 5.2619 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.14832 |
| Heavy Atoms | 26 |
| Complexity | 805.50464 |
Chemical Identifiers
| CAS Number | 860609-19-4 |
|---|---|
| SMILES | CCCN1C(=O)C=C(N=C1SCC2=CC=C(C=C2)C(C)(C)C)C(F)(F)F |
Product Overview
10J-321S (CAS 860609-19-4), with molecular formula C19H23F3N2OS and molecular weight 384.15 g/mol. IUPAC: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-propyl-6-(trifluoromethyl)pyrimidin-4-one.
Chemical Property Profile of 10J-321S
Property Insights of 10J-321S
The XLogP value of 5.2619 indicates that 10J-321S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 10J-321S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10J-321S has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 10J-321S?
The CAS number of 10J-321S is 860609-19-4.
What is the molecular formula of 10J-321S?
The molecular formula of 10J-321S is C19H23F3N2OS.
What is the molecular weight of 10J-321S?
The molecular weight of 10J-321S is 384.15 g/mol.
Where can I buy 10J-321S?
You can request a quote for 10J-321S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10J-321S?
Yes, KEHONG BIO provides custom synthesis services for 10J-321S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.