![(7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one structure](/static/products/121/1212198-43-0.webp)
(7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
TL;DR: (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one (CAS 1212198-43-0) is a chemical compound with molecular formula C28H32N2O4 and molecular weight 460.2362 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(7S)-1,2,3-trimethoxy-7-(methylamino)-10-(2-phenylethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
Also Known As: (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one, (7S)-1,2,3-trimethoxy-7-(methylamino)-10-[(2-phenylethyl)amino]-6,7-dihydrobenzo[a]heptalen-9(5H)-one, (S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydrobenzo[a]heptalen-9(5H)-one
Technical Specifications
| Molecular Formula | C28H32N2O4 |
| Molecular Weight | 460.2362 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 68.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 460.2362 Da |
| Heavy Atoms | 34 |
| Complexity | 798.0 |
| SMILES | CN[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)NCCC4=CC=CC=C4)OC)OC)OC |
| InChIKey | QNWLRLYUDWCCDP-QFIPXVFZSA-N |
Chemical Property Profile of (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
Property Insights of (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
The XLogP value of 3.3 indicates that (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one. Following Lipinski's Rule of Five, (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one?
The CAS number of (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one is 1212198-43-0.
What is the molecular formula of (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one?
The molecular formula of (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one is C28H32N2O4.
What is the molecular weight of (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one?
The molecular weight of (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one is 460.2362 g/mol.
Where can I buy (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one?
You can request a quote for (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one?
Yes, CoreyChem provides custom synthesis services for (7S)-1,2,3-trimethoxy-7-(methylamino)-10-(phenethylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.