C34H48N6O6S2
TL;DR: C34H48N6O6S2 (CAS 716342-39-1) is a chemical compound with molecular formula C34H48N6O6S2 and molecular weight 700.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butan-2-yl-1-[2-[6-[(E)-[(E)-[6-[2-[butan-2-ylcarbamothioyl(methyl)amino]ethyl]-4-methoxy-1,3-benzodioxol-5-yl]methylidenehydrazinylidene]methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea
Also Known As: 1,1'-((6,6'-((1E,1'E)-hydrazine-1,2-diylidenebis(methanylylidene))bis(7-methoxybenzo[d][1,3]dioxole-6,5-diyl))bis(ethane-2,1-diyl))bis(3-(sec-butyl)-1-methylthiourea), 1,1'-{(1E,2E)-hydrazine-1,2-diylidenebis[(E)methylylidene(7-methoxy-1,3-benzodioxole-6,5-diyl)ethane-2,1-diyl]}bis[3-butan-2-yl-1-methyl(thiourea)]
| Molecular Formula | C34H48N6O6S2 |
|---|---|
| Molecular Weight | 700.31 g/mol |
| LogP | 4.9088 |
| Topological Polar Surface Area | 110.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 700.3077 |
| Heavy Atoms | 48 |
| Complexity | 1408.4164 |
Chemical Identifiers
| CAS Number | 716342-39-1 |
|---|---|
| SMILES | CCC(NC(=S)N(CCC1=CC2=C(OCO2)C(=C1/C=N/N=C/C3=C(C4=C(OCO4)C=C3CCN(C(=S)NC(CC)C)C)OC)OC)C)C |
Product Overview
C34H48N6O6S2 (CAS 716342-39-1), with molecular formula C34H48N6O6S2 and molecular weight 700.31 g/mol. IUPAC: 3-butan-2-yl-1-[2-[6-[(E)-[(E)-[6-[2-[butan-2-ylcarbamothioyl(methyl)amino]ethyl]-4-methoxy-1,3-benzodioxol-5-yl]methylidenehydrazinylidene]methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea.
Chemical Property Profile of C34H48N6O6S2
Property Insights of C34H48N6O6S2
The XLogP value of 4.9088 indicates that C34H48N6O6S2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.64 Ų falls within the moderate polarity range, balancing permeability and solubility for C34H48N6O6S2. Following Lipinski's Rule of Five, C34H48N6O6S2 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C34H48N6O6S2?
The CAS number of C34H48N6O6S2 is 716342-39-1.
What is the molecular formula of C34H48N6O6S2?
The molecular formula of C34H48N6O6S2 is C34H48N6O6S2.
What is the molecular weight of C34H48N6O6S2?
The molecular weight of C34H48N6O6S2 is 700.31 g/mol.
Where can I buy C34H48N6O6S2?
You can request a quote for C34H48N6O6S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C34H48N6O6S2?
Yes, KEHONG BIO provides custom synthesis services for C34H48N6O6S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.