N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide
TL;DR: N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide (CAS 19157-69-8) is a chemical compound with molecular formula C30H45NO3S and molecular weight 499.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methylundecanamide
Also Known As: Bmbhtd, KST-1A2371, KST-1A2373, N-Butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide, ( inverted exclamation markA)-11-((1,2-bis(4-hydroxyphenyl)ethyl)thio)-n-butyl-n-methylundecanamide
| Molecular Formula | C30H45NO3S |
|---|---|
| Molecular Weight | 499.31 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 86.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 499.312 |
| Heavy Atoms | 35 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 19157-69-8 |
|---|---|
| SMILES | CCCCN(C)C(=O)CCCCCCCCCCSC(CC1=CC=C(C=C1)O)C2=CC=C(C=C2)O |
| InChIKey | FOQWMBMXFCBRBN-UHFFFAOYSA-N |
Product Overview
N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide (CAS 19157-69-8), with molecular formula C30H45NO3S and molecular weight 499.31 g/mol. IUPAC: 11-[1,2-bis(4-hydroxyphenyl)ethylsulfanyl]-N-butyl-N-methylundecanamide.
Chemical Property Profile of N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide
Property Insights of N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide
The XLogP value of 8.1 indicates that N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide. Following Lipinski's Rule of Five, N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide?
The CAS number of N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide is 19157-69-8.
What is the molecular formula of N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide?
The molecular formula of N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide is C30H45NO3S.
What is the molecular weight of N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide?
The molecular weight of N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide is 499.31 g/mol.
Where can I buy N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide?
You can request a quote for N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-N-methyl-13,14-bis(4'-hydroxyphenyl)-12-thiatetradecanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.