![N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide structure](/static/products/488/488746-91-4.png)
N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide
TL;DR: N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide (CAS 488746-91-4) is a chemical compound with molecular formula C27H27N3O2S2 and molecular weight 489.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-[[13-(3-methylphenyl)-12-oxo-17-thia-13,15-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16),14-hexaen-14-yl]sulfanyl]acetamide
Also Known As: N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide, N,N-diethyl-2-{[8-(3-methylphenyl)-7-oxo-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl]sulfanyl}acetamide
| Molecular Formula | C27H27N3O2S2 |
|---|---|
| Molecular Weight | 489.15 g/mol |
| LogP | 5.48172 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 489.15448 |
| Heavy Atoms | 34 |
| Complexity | 1450.2803 |
Chemical Identifiers
| CAS Number | 488746-91-4 |
|---|---|
| SMILES | CCN(CC)C(=O)CSC1=NC2=C(C3=C(S2)C4=CC=CC=C4CC3)C(=O)N1C5=CC=CC(=C5)C |
Product Overview
N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide (CAS 488746-91-4), with molecular formula C27H27N3O2S2 and molecular weight 489.15 g/mol. IUPAC: N,N-diethyl-2-[[13-(3-methylphenyl)-12-oxo-17-thia-13,15-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,11(16),14-hexaen-14-yl]sulfanyl]acetamide.
Chemical Property Profile of N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide
Property Insights of N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide
The XLogP value of 5.48172 indicates that N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide 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 N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide?
The CAS number of N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide is 488746-91-4.
What is the molecular formula of N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide?
The molecular formula of N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide is C27H27N3O2S2.
What is the molecular weight of N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide?
The molecular weight of N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide is 489.15 g/mol.
Where can I buy N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide?
You can request a quote for N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-2-((7-oxo-8-(m-tolyl)-5,6,7,8-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-9-yl)thio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.