Saframycin Ad-1
TL;DR: Saframycin Ad-1 (CAS 107140-87-4) is a chemical compound with molecular formula C30H32N4O8 and molecular weight 576.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(12-cyano-7,18-dimethoxy-6,17,21-trimethyl-5,8,16,19-tetraoxo-11,21-diazapentacyclo[11.7.1.02,11.04,9.015,20]henicosa-4(9),6,15(20),17-tetraen-10-yl)methyl]-2-oxobutanamide
Also Known As: Saframycin Ad-1, Saframycin-Ad-1, 2,2'-(ethane-1,2-diylbis(oxy))bis(4-fluoroaniline), 2-Thiazolamine, 4-(2,3-dihydro-2-methyl-5-benzofuranyl)-, Butanamide, N-((7-cyano-1,5,6,7,9,10,13,14,14a,15-decahydro-2,11-dimethoxy-3,12,16-trimethyl-1,4,10,13-tetraoxo-6,15-imino-4H-isoquino(3,2-b)(3)benzazocin-9-yl)methyl)-2-oxo-, (6R-(6alpha,7beta,9alpha,14abeta,15alpha))-
| Molecular Formula | C30H32N4O8 |
|---|---|
| Molecular Weight | 576.22 g/mol |
| LogP | 0.24068 |
| Topological Polar Surface Area | 163.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 576.222 |
| Heavy Atoms | 42 |
| Complexity | 1539.6598 |
Chemical Identifiers
| CAS Number | 107140-87-4 |
|---|---|
| SMILES | CCC(=O)C(=O)NCC1C2=C(CC3N1C(C4CC5=C(C3N4C)C(=O)C(=C(C5=O)C)OC)C#N)C(=O)C(=C(C2=O)OC)C |
Product Overview
Saframycin Ad-1 (CAS 107140-87-4), with molecular formula C30H32N4O8 and molecular weight 576.22 g/mol. IUPAC: N-[(12-cyano-7,18-dimethoxy-6,17,21-trimethyl-5,8,16,19-tetraoxo-11,21-diazapentacyclo[11.7.1.02,11.04,9.015,20]henicosa-4(9),6,15(20),17-tetraen-10-yl)methyl]-2-oxobutanamide.
Chemical Property Profile of Saframycin Ad-1
Property Insights of Saframycin Ad-1
The XLogP value of 0.24068 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Saframycin Ad-1. The TPSA of 163.18 Ų indicates high polarity, suggesting Saframycin Ad-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Saframycin Ad-1 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Saframycin Ad-1?
The CAS number of Saframycin Ad-1 is 107140-87-4.
What is the molecular formula of Saframycin Ad-1?
The molecular formula of Saframycin Ad-1 is C30H32N4O8.
What is the molecular weight of Saframycin Ad-1?
The molecular weight of Saframycin Ad-1 is 576.22 g/mol.
Where can I buy Saframycin Ad-1?
You can request a quote for Saframycin Ad-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Saframycin Ad-1?
Yes, KEHONG BIO provides custom synthesis services for Saframycin Ad-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.