![1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea structure](/static/products/4953/495375-80-9.webp)
1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea
TL;DR: 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea (CAS 495375-80-9) is a chemical compound with molecular formula C20H25N3O3S and molecular weight 387.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea
Also Known As: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea, N-[4-(1-AZEPANYLSULFONYL)PHENYL]-N'-(4-METHYLPHENYL)UREA
| Molecular Formula | C20H25N3O3S |
|---|---|
| Molecular Weight | 387.16 g/mol |
| LogP | 4.20372 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.16165 |
| Heavy Atoms | 27 |
| Complexity | 869.6929 |
Chemical Identifiers
| CAS Number | 495375-80-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3 |
Product Overview
1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea (CAS 495375-80-9), with molecular formula C20H25N3O3S and molecular weight 387.16 g/mol. IUPAC: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea.
Chemical Property Profile of 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea
Property Insights of 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea
The XLogP value of 4.20372 indicates that 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea. Following Lipinski's Rule of Five, 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea has 2 hydrogen bond donor(s) and 3 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 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea?
The CAS number of 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea is 495375-80-9.
What is the molecular formula of 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea?
The molecular formula of 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea is C20H25N3O3S.
What is the molecular weight of 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea?
The molecular weight of 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea is 387.16 g/mol.
Where can I buy 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea?
You can request a quote for 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.