A3667/0155438
TL;DR: A3667/0155438 (CAS 698981-76-9) is a chemical compound with molecular formula C25H28N2O3S and molecular weight 436.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethyl]-7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione
Also Known As: A3667/0155438, 1-[2-(3,4-dimethoxyphenyl)ethyl]-7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione, 1-(3,4-dimethoxyphenethyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-7,7-dimethyl-2-phenyl-1,5,7,8-tetrahydro-4H-pyrano[4,3-d]pyrimidine-4-thione, 1-[2-(3,4-DIMETHOXYPHENYL)ETHYL]-7,7-DIMETHYL-2-PHENYL-1H,4H,5H,7H,8H-PYRANO[4,3-D]PYRIMIDINE-4-THIONE
| Molecular Formula | C25H28N2O3S |
|---|---|
| Molecular Weight | 436.18 g/mol |
| LogP | 5.39079 |
| Topological Polar Surface Area | 45.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 436.18207 |
| Heavy Atoms | 31 |
| Complexity | 1139.4943 |
Chemical Identifiers
| CAS Number | 698981-76-9 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=S)N=C(N2CCC3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4)C |
Product Overview
A3667/0155438 (CAS 698981-76-9), with molecular formula C25H28N2O3S and molecular weight 436.18 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]-7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione.
Chemical Property Profile of A3667/0155438
Property Insights of A3667/0155438
The XLogP value of 5.39079 indicates that A3667/0155438 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.51 Ų, A3667/0155438 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3667/0155438 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 A3667/0155438?
The CAS number of A3667/0155438 is 698981-76-9.
What is the molecular formula of A3667/0155438?
The molecular formula of A3667/0155438 is C25H28N2O3S.
What is the molecular weight of A3667/0155438?
The molecular weight of A3667/0155438 is 436.18 g/mol.
Where can I buy A3667/0155438?
You can request a quote for A3667/0155438 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3667/0155438?
Yes, KEHONG BIO provides custom synthesis services for A3667/0155438 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.