Secocolchicine
TL;DR: Secocolchicine (CAS 61014-70-8) is a chemical compound with molecular formula C22H25NO7 and molecular weight 415.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4,5,14-tetramethoxy-13-oxo-15-oxatetracyclo[9.6.0.01,14.02,7]heptadeca-2,4,6,11,16-pentaen-10-yl)acetamide
Also Known As: Secocolchicine, (-)-10,11-oxy-10,12a-cyclo-10,11-secocolchicine, 1-Piperazinepropanol, 4-(8-(methylthio)dibenzo(b,f)thiepin-10-yl)-, (Z)-2-butenedioate (1:1), Acetamide, N-(7a,8,11,12-tetrahydro-2,3,4,7a-tetramethoxy-8-oxo-10H-benz(7,8)azuleno(1,8a)(b)furan-10-yl)-, (7aR-(4bR*,7aalpha,10beta))-, N-(3a,10,11,12-Tetramethoxy-4-oxo-4,6,7,8-tetrahydro-3aH-benzo[7,8]azuleno[1,8a-b]furan-6-yl)ethanimidic acid
| Molecular Formula | C22H25NO7 |
|---|---|
| Molecular Weight | 415.16 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 415.16312 |
| Heavy Atoms | 30 |
| Complexity | 779.0 |
Chemical Identifiers
| CAS Number | 61014-70-8 |
|---|---|
| SMILES | CC(=O)NC1CCC2=CC(=C(C(=C2C34C1=CC(=O)C3(OC=C4)OC)OC)OC)OC |
| InChIKey | FFDCJEBRJMKLSJ-UHFFFAOYSA-N |
Product Overview
Secocolchicine (CAS 61014-70-8), with molecular formula C22H25NO7 and molecular weight 415.16 g/mol. IUPAC: N-(3,4,5,14-tetramethoxy-13-oxo-15-oxatetracyclo[9.6.0.01,14.02,7]heptadeca-2,4,6,11,16-pentaen-10-yl)acetamide.
Chemical Property Profile of Secocolchicine
Property Insights of Secocolchicine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Secocolchicine. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Secocolchicine. Following Lipinski's Rule of Five, Secocolchicine has 1 hydrogen bond donor(s) and 7 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 Secocolchicine?
The CAS number of Secocolchicine is 61014-70-8.
What is the molecular formula of Secocolchicine?
The molecular formula of Secocolchicine is C22H25NO7.
What is the molecular weight of Secocolchicine?
The molecular weight of Secocolchicine is 415.16 g/mol.
Where can I buy Secocolchicine?
You can request a quote for Secocolchicine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Secocolchicine?
Yes, KEHONG BIO provides custom synthesis services for Secocolchicine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.