benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate
TL;DR: benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate (CAS 147169-19-5) is a chemical compound with molecular formula C22H27NO4S and molecular weight 401.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[cyclohexyl-(4-methylphenyl)sulfonylmethyl]carbamate
Also Known As: benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate, Cyclohexyltosylmethylcarbamic acid benzyl ester, J1.295.041A, benzyl N-[cyclohexyl-(4-methylphenyl)sulfonylmethyl]carbamate, 2T-0204
| Molecular Formula | C22H27NO4S |
|---|---|
| Molecular Weight | 401.17 g/mol |
| LogP | 4.60152 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.16608 |
| Heavy Atoms | 28 |
| Complexity | 872.5126 |
Chemical Identifiers
| CAS Number | 147169-19-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(C2CCCCC2)NC(=O)OCC3=CC=CC=C3 |
Product Overview
benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate (CAS 147169-19-5), with molecular formula C22H27NO4S and molecular weight 401.17 g/mol. IUPAC: benzyl N-[cyclohexyl-(4-methylphenyl)sulfonylmethyl]carbamate.
Chemical Property Profile of benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate
Property Insights of benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate
The XLogP value of 4.60152 indicates that benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate. Following Lipinski's Rule of Five, benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate has 1 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 benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate?
The CAS number of benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate is 147169-19-5.
What is the molecular formula of benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate?
The molecular formula of benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate is C22H27NO4S.
What is the molecular weight of benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate?
The molecular weight of benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate is 401.17 g/mol.
Where can I buy benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate?
You can request a quote for benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate?
Yes, KEHONG BIO provides custom synthesis services for benzyl N-{cyclohexyl[(4-methylphenyl)sulfonyl]methyl}carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.