N-Methylisocolchicine
TL;DR: N-Methylisocolchicine (CAS 7404-91-3) is a chemical compound with molecular formula C23H27NO6 and molecular weight 413.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(1,2,3,9-tetramethoxy-10-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
Also Known As: N-Methylisocolchicine, Isocolchicine, N-methyl-, n-methyl-n-(1,2,3,9-tetramethoxy-10-oxo-5,6,7,10-tetrahydrobenzo[a]heptalen-7-yl)acetamide, N-methyl-N-(1,2,3,9-tetramethoxy-10-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
| Molecular Formula | C23H27NO6 |
|---|---|
| Molecular Weight | 413.18 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.18384 |
| Heavy Atoms | 30 |
| Complexity | 770.0 |
Chemical Identifiers
| CAS Number | 7404-91-3 |
|---|---|
| SMILES | CC(=O)N(C)C1CCC2=CC(=C(C(=C2C3=C1C=C(C(=O)C=C3)OC)OC)OC)OC |
| InChIKey | AUUNODHKWINPRL-UHFFFAOYSA-N |
Product Overview
N-Methylisocolchicine (CAS 7404-91-3), with molecular formula C23H27NO6 and molecular weight 413.18 g/mol. IUPAC: N-methyl-N-(1,2,3,9-tetramethoxy-10-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide.
Chemical Property Profile of N-Methylisocolchicine
Property Insights of N-Methylisocolchicine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methylisocolchicine. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methylisocolchicine. Following Lipinski's Rule of Five, N-Methylisocolchicine has 0 hydrogen bond donor(s) and 6 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 N-Methylisocolchicine?
The CAS number of N-Methylisocolchicine is 7404-91-3.
What is the molecular formula of N-Methylisocolchicine?
The molecular formula of N-Methylisocolchicine is C23H27NO6.
What is the molecular weight of N-Methylisocolchicine?
The molecular weight of N-Methylisocolchicine is 413.18 g/mol.
Where can I buy N-Methylisocolchicine?
You can request a quote for N-Methylisocolchicine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylisocolchicine?
Yes, KEHONG BIO provides custom synthesis services for N-Methylisocolchicine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.