![N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea structure](/static/products/5904/590400-06-9.webp)
N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea
TL;DR: N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea (CAS 590400-06-9) is a chemical compound with molecular formula C16H23N3O3S2 and molecular weight 369.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(azepan-1-ylsulfonyl)phenyl]carbamothioyl]propanamide
Also Known As: N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea, N-((4-(azepan-1-ylsulfonyl)phenyl)carbamothioyl)propionamide, N-[[4-(azepan-1-ylsulfonyl)phenyl]carbamothioyl]propanamide, 1-[4-(AZEPANE-1-SULFONYL)PHENYL]-3-PROPANOYLTHIOUREA, AN-329/41572803
| Molecular Formula | C16H23N3O3S2 |
|---|---|
| Molecular Weight | 369.12 g/mol |
| LogP | 2.4743 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.11807 |
| Heavy Atoms | 24 |
| Complexity | 679.0241 |
Chemical Identifiers
| CAS Number | 590400-06-9 |
|---|---|
| SMILES | CCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2 |
Product Overview
N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea (CAS 590400-06-9), with molecular formula C16H23N3O3S2 and molecular weight 369.12 g/mol. IUPAC: N-[[4-(azepan-1-ylsulfonyl)phenyl]carbamothioyl]propanamide.
Chemical Property Profile of N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea
Property Insights of N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea
The XLogP value of 2.4743 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea. Following Lipinski's Rule of Five, N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea has 2 hydrogen bond donor(s) and 4 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-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea?
The CAS number of N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea is 590400-06-9.
What is the molecular formula of N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea?
The molecular formula of N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea is C16H23N3O3S2.
What is the molecular weight of N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea?
The molecular weight of N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea is 369.12 g/mol.
Where can I buy N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea?
You can request a quote for N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(1-azepanylsulfonyl)phenyl]-N'-propionylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.