![(S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide structure](/static/products/121/1212093-38-3.webp)
(S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide
TL;DR: (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide (CAS 1212093-38-3) is a chemical compound with molecular formula C25H30N2O5 and molecular weight 438.21548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(7S)-1,2,3-trimethoxy-9-oxo-10-pyrrolidin-1-yl-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
Also Known As: (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide, N-[(7S)-1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide, N-[(7S)-1,2,3-trimethoxy-9-oxo-10-pyrrolidin-1-yl-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
Technical Specifications
| Molecular Formula | C25H30N2O5 |
| Molecular Weight | 438.21548 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.21548 Da |
| Heavy Atoms | 32 |
| Complexity | 826.0 |
| SMILES | CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)N4CCCC4)OC)OC)OC |
| InChIKey | NBUBANVFAQHMBD-IBGZPJMESA-N |
Chemical Property Profile of (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide
Property Insights of (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide. Following Lipinski's Rule of Five, (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide has 1 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 (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide?
The CAS number of (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide is 1212093-38-3.
What is the molecular formula of (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide?
The molecular formula of (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide is C25H30N2O5.
What is the molecular weight of (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide?
The molecular weight of (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide is 438.21548 g/mol.
Where can I buy (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide?
You can request a quote for (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for (S)-N-(1,2,3-trimethoxy-9-oxo-10-(pyrrolidin-1-yl)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.