1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea
TL;DR: 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea (CAS 369607-50-1) is a chemical compound with molecular formula C18H19N3OS2 and molecular weight 357.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea
Also Known As: 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea, 1-(3-cyano-5-ethyl-5-methyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)-3-phenylthiourea
| Molecular Formula | C18H19N3OS2 |
|---|---|
| Molecular Weight | 357.10 g/mol |
| LogP | 4.67008 |
| Topological Polar Surface Area | 57.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.09695 |
| Heavy Atoms | 24 |
| Complexity | 794.58545 |
Chemical Identifiers
| CAS Number | 369607-50-1 |
|---|---|
| SMILES | CCC1(CC2=C(CO1)SC(=C2C#N)NC(=S)NC3=CC=CC=C3)C |
Product Overview
1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea (CAS 369607-50-1), with molecular formula C18H19N3OS2 and molecular weight 357.10 g/mol. IUPAC: 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea.
Chemical Property Profile of 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea
Property Insights of 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea
The XLogP value of 4.67008 indicates that 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.08 Ų, 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea has 2 hydrogen bond donor(s) and 4 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 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea?
The CAS number of 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea is 369607-50-1.
What is the molecular formula of 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea?
The molecular formula of 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea is C18H19N3OS2.
What is the molecular weight of 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea?
The molecular weight of 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea is 357.10 g/mol.
Where can I buy 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea?
You can request a quote for 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.