6-methyl-3-prop-2-enylhept-5-en-2-one
TL;DR: 6-methyl-3-prop-2-enylhept-5-en-2-one (CAS 27228-62-2) is a chemical compound with molecular formula C24H36N4O and molecular weight 396.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,1-N-diethyl-4-N-(2,6,6-trimethyl-5-phenyl-5H-furo[2,3-d]pyrimidin-4-yl)pentane-1,4-diamine
Also Known As: 6-methyl-3-prop-2-enylhept-5-en-2-one, 1-N,1-N-diethyl-4-N-(2,6,6-trimethyl-5-phenyl-5H-furo[2,3-d]pyrimidin-4-yl)pentane-1,4-diamine, n1,n1-diethyl-n4-(2,6,6-trimethyl-5-phenyl-5,6-dihydrofuro[2,3-d]pyrimidin-4-yl)pentane-1,4-diamine, 2,6,6-Trimethyl-4-[6-diethylamino-.alpha.-methylbutylamino]-5-phenyl-5,6-dihydrofuro[2,3-d]pyrimidine, N~1~,N~1~-Diethyl-N~4~-(2,6,6-trimethyl-5-phenyl-5,6-dihydrofuro[2,3-d]pyrimidin-4-yl)pentane-1,4-diamine
| Molecular Formula | C24H36N4O |
|---|---|
| Molecular Weight | 396.29 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 50.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 396.2889 |
| Heavy Atoms | 29 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 27228-62-2 |
|---|---|
| SMILES | CCN(CC)CCCC(C)NC1=C2C(C(OC2=NC(=N1)C)(C)C)C3=CC=CC=C3 |
| InChIKey | YDGXKUDVQSMUDF-UHFFFAOYSA-N |
Product Overview
6-methyl-3-prop-2-enylhept-5-en-2-one (CAS 27228-62-2), with molecular formula C24H36N4O and molecular weight 396.29 g/mol. IUPAC: 1-N,1-N-diethyl-4-N-(2,6,6-trimethyl-5-phenyl-5H-furo[2,3-d]pyrimidin-4-yl)pentane-1,4-diamine.
Chemical Property Profile of 6-methyl-3-prop-2-enylhept-5-en-2-one
Property Insights of 6-methyl-3-prop-2-enylhept-5-en-2-one
The XLogP value of 5.2 indicates that 6-methyl-3-prop-2-enylhept-5-en-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.3 Ų, 6-methyl-3-prop-2-enylhept-5-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-methyl-3-prop-2-enylhept-5-en-2-one has 1 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 6-methyl-3-prop-2-enylhept-5-en-2-one?
The CAS number of 6-methyl-3-prop-2-enylhept-5-en-2-one is 27228-62-2.
What is the molecular formula of 6-methyl-3-prop-2-enylhept-5-en-2-one?
The molecular formula of 6-methyl-3-prop-2-enylhept-5-en-2-one is C24H36N4O.
What is the molecular weight of 6-methyl-3-prop-2-enylhept-5-en-2-one?
The molecular weight of 6-methyl-3-prop-2-enylhept-5-en-2-one is 396.29 g/mol.
Where can I buy 6-methyl-3-prop-2-enylhept-5-en-2-one?
You can request a quote for 6-methyl-3-prop-2-enylhept-5-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-methyl-3-prop-2-enylhept-5-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-methyl-3-prop-2-enylhept-5-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.