N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide
TL;DR: N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide (CAS 294847-84-0) is a chemical compound with molecular formula C18H28N2O4S and molecular weight 368.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide
Also Known As: N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide
| Molecular Formula | C18H28N2O4S |
|---|---|
| Molecular Weight | 368.18 g/mol |
| LogP | 2.2573 |
| Topological Polar Surface Area | 79.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 368.17697 |
| Heavy Atoms | 25 |
| Complexity | 522.31226 |
Chemical Identifiers
| CAS Number | 294847-84-0 |
|---|---|
| SMILES | CCCCCCOCC(CNC(=S)NC(=O)C1=CC=C(C=C1)OC)O |
Product Overview
N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide (CAS 294847-84-0), with molecular formula C18H28N2O4S and molecular weight 368.18 g/mol. IUPAC: N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide.
Chemical Property Profile of N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide
Property Insights of N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide
The XLogP value of 2.2573 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide. The TPSA of 79.82 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide. Following Lipinski's Rule of Five, N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide has 3 hydrogen bond donor(s) and 5 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-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide?
The CAS number of N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide is 294847-84-0.
What is the molecular formula of N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide?
The molecular formula of N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide is C18H28N2O4S.
What is the molecular weight of N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide?
The molecular weight of N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide is 368.18 g/mol.
Where can I buy N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide?
You can request a quote for N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-hexoxy-2-hydroxypropyl)carbamothioyl]-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.